NAV

Chloroxylenol

Identification

Summary

Chloroxylenol is an antimicrobial used to treat cuts, bites, stings, abrasions, and used as an antiseptic hand cleaner.

Brand Names
Cortane-B
Generic Name
Chloroxylenol
DrugBank Accession Number
DB11121
Background

Chloroxylenol, or para-chloro-meta-xylenol (PCMX), is an antiseptic and disinfectant agent used for skin disinfection and surgical instruments. It is found in antibacterial soaps, wound-cleansing applications, and household antiseptics. The halophenol is shown to be most effective against Gram positive bacteria where it disrupts the cell wall due to its phenolic nature 1. Chloroxylenol is on the World Health Organization's List of Essential Medicines.

Type
Small Molecule
Groups
Approved
Structure
3D
Similar Structures
Weight
Average: 156.61
Monoisotopic: 156.0341926
Chemical Formula
C8H9ClO
Synonyms
  • 2-chloro-5-hydroxy-1,3-dimethylbenzene
  • 2-chloro-5-hydroxy-m-xylene
  • 2-Chloro-m-xylenol
  • 3,5-dimethyl-4-chlorophenol
  • 4-chloro-1-hydroxy-3,5-dimethylbenzene
  • 4-chloro-3,5-dimethylphenol
  • 4-chloro-m-xylenol
  • chloro-xylenol
  • Chloroxylenol
  • cloroxilenol
  • p-chloro-3,5-xylenol
  • p-chloro-m-xylenol
  • parachlorometaxylenol
  • PCMX

Pharmacology

Indication

The predominant medical applications for which chloroxylenol is formally indicated for therapeutic use is as an application to the skin for use in cuts, bites, stings, abrasions, and for use as antiseptic hand cleaner 7.

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Associated Conditions
Associated Therapies
Contraindications & Blackbox Warnings
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Pharmacodynamics

Chloroxylenol is a substituted phenol which has been widely used for many years as an ingredient of antiseptic and disinfectant products intended for external use 9. It is known to be bactericidal in low concentration to a wide range of Gram positive and Gram negative bacteria 9.

Mechanism of action

As a phenol antiseptic, it is believed that the hydroxyl -OH groups of the chloroxylenol molecule binds to certain proteins on the cell membrane of bacteria, and disrupts the membrane so as to allow the contents of the bacterial cell to leak out 1. This allows chloroxylenol to enter the bacterial cell to bind further with more proteins and enzymes to disable the cell's functioning 1. At particularly high concentrations of chloroxylenol, the protein and nucleic acid content of targeted bacterial cells become coagulated and cease to function, leading to rapid cell death 1.

Absorption

No chloroxylenol was detected in the blood following the dermal administration of 2 g of p-chloroxylenol in an ethanol/olive oil vehicle in human subjects 3. After a dose of 5 g, only traces were found, after 8 g, 1 mg % (1 mg/dL) was found in the blood after 3 hours, and 4 mg % (4 mg/dL) after 24 hours 3. After a dose of 20 g, 4 mg % (4 mg/dL) was measured after half an hour, and 1 mg % (1 mg/dL) was present at 72 hours 3.

For antiseptic purposes, chloroxylenol is considered to be well-absorbed when applied to the skin 9.

Volume of distribution

The only data available regarding the volume of distribution of chloroxylenol is the mean Vss of 22.45 L determined after 200 mg intravenous single dose of chloroxylenol was administered to healthy mongrel dog subjects 6,8.

Protein binding

One study determined the protein binding of chloroxylenol to be approximately 85.2% +/- 2.32% for serum albumin and 89.8% +/- 2.99% for whole human serum 2.

Metabolism

Certain animal studies have shown that following dermal application of chloroxylenol, that the absorption was rapid with a Cmax = 1-2 hours, and that the administered substance was excreted via the kidney with almost complete elimination within 24 hours 7. The primary metabolites discovered in the excreted urine were glucuronides and sulfates 7. Some chloroxylenol monographs liken its pharmacokinetic profile to that of another antiseptic - triclosan - which is rapidly excreted in the urine also as a glucuronide metabolite, as observed in the human model 7.

Moreover, In one human subject administered 5 mg intragluteally, 14% was excreted with glucuronic acid and 17% with sulfuric acid at 3 days 4.

Any chloroxylenol absorbed into the body is likely extensively metabolized by the liver and rapidly excreted, mainly in the urine, as sulphate and glucuronide conjugates 9.

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Route of elimination

The major route of excretion is likely in urine 8,7, although some amounts may be found in bile and traces in exhaled air 6.

Half-life

One study estimated the mean terminal half-life and mean residence time after a 200 mg intravenous single dose of chloroxylenol in healthy mongrel dog subjects to be 1.7 and 1.69 hours, respectively 6,8. Alternatively, some product monographs liken chloroxylenol to a similar liquid antiseptic, triclosan, whose calculated urinary excretion half-life in man is approximately 10 hours 7.

Clearance

The only data available regarding the clearance of chloroxylenol is the mean clearance rate of 13.76 L/hr following a 200 mg intravenous single dose of the substance into healthy mongrel dog subjects 6,8.

Moreover, in another study, when 8 g of chloroxylenol was administered dermal on a human subject in an alcohol/glycerin vehicle, 11% was excreted in 48 hours 4.

Adverse Effects
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Toxicity

As chloroxylenol is predominantly employed as an active ingredient in various liquids or creams as cleaners, disinfectants, or antiseptics that are generally designed to be used topically, it is widely accepted that the use of such liquids - when used appropriately - is unlikely to present a sufficient volume that could be ingested to cause any medical problems 7. In the event of accidental eye contact, was with Luke warm water 7.

Chloroxylenol is known to have a low systemic toxicity, even at dosage levels many times higher that those likely to be absorbed during normal usage of the agent 9.

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
DrugInteraction
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Tenofovir alafenamideThe serum concentration of Tenofovir alafenamide can be increased when it is combined with Chloroxylenol.
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Food Interactions
No interactions found.

Products

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dosage, form, labeller, route of administration, and marketing period.
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Active Moieties
NameKindUNIICASInChI Key
Phenolunknown339NCG44TV108-95-2ISWSIDIOOBJBQZ-UHFFFAOYSA-N
Over the Counter Products
NameDosageStrengthRouteLabellerMarketing StartMarketing EndRegionImage
1012 AntimicrobialSoap3 mg/1mLTopicalABC Compounding Co., Inc.2013-05-01Not applicableUS flag
986 Antiseptic Hand Soap-lot 0.5%Lotion0.5 %TopicalFuller Brush/Les Brosses Fuller1994-12-311995-08-01Canada flag
ACQUAINT Antibacterial Foam HandwashLiquid0.003 mg/1mLTopicalGOJO Industries, Inc.2004-09-09Not applicableUS flag
ACQUAINT Antibacterial Foam HandwashLiquid.05 mg/1mLTopicalGOJO Industries, Inc.2019-06-15Not applicableUS flag
Acute Kare Hand Sp.Solution0.5 g/100mLTopicalDeb Canada2017-03-012017-03-01US flag
Acute-Kare Healthcare Personnel HandwashSoap1 g/100mLTopicalSC Johnson Professional USA, Inc.2018-02-01Not applicableUS flag
Acute-Kare Healthcare Personnel HandwashSoap1 g/100mLTopicalSTERIS Corporation1995-01-172019-03-19US flag
adriana GoldLiquid0.3 g/100mLTopicalOstl, Inc.2018-01-31Not applicableUS flag
ADVANTAGE CHEMICAL Premium Antibacterial Foaming Hand So apLiquid0.005 mg/1mLTopicalAdvantage Chemical, Inc.2015-04-15Not applicableUS flag
Aero CleansE2 AntibacterialLiquid2.1 mL/100mLTopicalDeb USA, Inc.2010-01-012018-04-01US flag
Mixture Products
NameIngredientsDosageRouteLabellerMarketing StartMarketing EndRegionImage
4246 First Aid KitChloroxylenol (0.1 g/100g) + Acetaminophen (325 mg/1) + Acetylsalicylic acid (325 mg/1) + Ammonia (0.045 g/0.3mL) + Benzocaine (5 g/100g) + Hydrocortisone acetate (1 g/100g) + Hydrocortisone acetate (1 g/100g) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (24.64 mg/1mL) + Lidocaine hydrochloride (2 g/100g) + Povidone-iodine (10 mg/1mL) + Water (98.6 mL/100mL)KitOphthalmic; Oral; Respiratory (inhalation); TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4334 First Aid KitChloroxylenol (0.1 g/100g) + Acetaminophen (500 mg/1) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Ethanol (0.5 mL/1mL) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (20 mg/1mL) + Lidocaine hydrochloride (2 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL)Gel; Kit; Liquid; Ointment; Swab; TabletOral; TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4357 First Aid KitChloroxylenol (0.1 g/100g) + Bacitracin zinc (400 [iU]/1g) + Benzethonium chloride (0.2 g/100g) + Benzocaine (10 g/100g) + Benzocaine (5 g/100g) + Hydrocortisone acetate (1 g/100g) + Hydrocortisone acetate (1 g/100g) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (2 g/100g) + Menthol (0.33 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Water (98.6 mL/100mL)Cream; Gel; Kit; Liquid; Ointment; Spray; SwabOphthalmic; TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4358 First Aid KitChloroxylenol (0.1 g/100g) + Ammonia (0.045 g/0.3mL) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL) + Water (98.6 mL/100mL)KitOphthalmic; Respiratory (inhalation); TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4367 First Aid KitChloroxylenol (0.1 g/100g) + Ammonia (0.045 g/0.3mL) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL) + Water (98.6 mL/100mL)KitOphthalmic; Respiratory (inhalation); TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4379 First Aid KitChloroxylenol (0.1 g/100g) + Acetaminophen (500 mg/1) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Ethanol (0.5 mL/1mL) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (2 g/100g) + Lidocaine hydrochloride (20 mg/1mL) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL)Gel; Kit; Liquid; Ointment; Swab; TabletOral; TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
Absorbine Jr Extra Strength LinimentChloroxylenol (0.5 %) + Levomenthol (4.0 %)LiquidTopicalBridges Consumer Healthcare Llc1992-12-31Not applicableCanada flag
Absorbine Jr LinimentChloroxylenol (0.5 %) + Levomenthol (1.25 %)SolutionTopicalBridges Consumer Healthcare Llc1993-12-31Not applicableCanada flag
Absorbine Power GelChloroxylenol (.5 %) + Levomenthol (4 %)GelTopicalW.F. Young, Inc.1993-12-31Not applicableCanada flag
Acne Aid GelChloroxylenol (.375 %) + Octasulfur (2.5 %) + Resorcinol (1.25 %)GelTopicalStiefel Laboratories, Inc.1966-12-311998-07-09Canada flag
Unapproved/Other Products
NameIngredientsDosageRouteLabellerMarketing StartMarketing EndRegionImage
4246 First Aid KitChloroxylenol (0.1 g/100g) + Acetaminophen (325 mg/1) + Acetylsalicylic acid (325 mg/1) + Ammonia (0.045 g/0.3mL) + Benzocaine (5 g/100g) + Hydrocortisone acetate (1 g/100g) + Hydrocortisone acetate (1 g/100g) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (24.64 mg/1mL) + Lidocaine hydrochloride (2 g/100g) + Povidone-iodine (10 mg/1mL) + Water (98.6 mL/100mL)KitOphthalmic; Oral; Respiratory (inhalation); TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4334 First Aid KitChloroxylenol (0.1 g/100g) + Acetaminophen (500 mg/1) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Ethanol (0.5 mL/1mL) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (20 mg/1mL) + Lidocaine hydrochloride (2 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL)Gel; Kit; Liquid; Ointment; Swab; TabletOral; TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4357 First Aid KitChloroxylenol (0.1 g/100g) + Bacitracin zinc (400 [iU]/1g) + Benzethonium chloride (0.2 g/100g) + Benzocaine (10 g/100g) + Benzocaine (5 g/100g) + Hydrocortisone acetate (1 g/100g) + Hydrocortisone acetate (1 g/100g) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (2 g/100g) + Menthol (0.33 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Water (98.6 mL/100mL)Cream; Gel; Kit; Liquid; Ointment; Spray; SwabOphthalmic; TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4358 First Aid KitChloroxylenol (0.1 g/100g) + Ammonia (0.045 g/0.3mL) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL) + Water (98.6 mL/100mL)KitOphthalmic; Respiratory (inhalation); TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4367 First Aid KitChloroxylenol (0.1 g/100g) + Ammonia (0.045 g/0.3mL) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL) + Water (98.6 mL/100mL)KitOphthalmic; Respiratory (inhalation); TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
4379 First Aid KitChloroxylenol (0.1 g/100g) + Acetaminophen (500 mg/1) + Bacitracin zinc (400 [iU]/1g) + Benzalkonium chloride (1.3 mg/1mL) + Benzocaine (5 g/100g) + Ethanol (0.5 mL/1mL) + Isopropyl alcohol (0.7 mL/1mL) + Lidocaine hydrochloride (2 g/100g) + Lidocaine hydrochloride (20 mg/1mL) + Neomycin sulfate (3.5 mg/1g) + Polymyxin B sulfate (5000 [iU]/1g) + Povidone-iodine (10 mg/1mL)Gel; Kit; Liquid; Ointment; Swab; TabletOral; TopicalHoneywell Safety Products USA, Inc2018-10-18Not applicableUS flag
Antibacterial FoamChloroxylenol (5 mL/1000mL)SoapTopicalSanihealth Products Corporation2010-05-18Not applicableUS flag
Champion Ultra CleanChloroxylenol (13 kg/100kg)LiquidTopicalMaintex2020-02-06Not applicableUS flag
Champion Ultra CleanChloroxylenol (13 kg/100kg)LiquidTopicalMorgan Gallacher Inc. Dba Custom Chemical Formulators Inc.2020-02-06Not applicableUS flag
Champion Ultra Clean Fragrance and Dye FreeChloroxylenol (13 kg/100kg)LiquidTopicalMorgan Gallacher Inc. Dba Custom Chemical Formulators Inc.2020-02-06Not applicableUS flag

Categories

ATC Codes
D08AE05 — Chloroxylenol
Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as meta cresols. These are aromatic compounds containing a meta-cresol moiety, which consists of a benzene ring bearing a methyl group and a hydroxyl group at ring positions 1 and 3, respectively.
Kingdom
Organic compounds
Super Class
Benzenoids
Class
Phenols
Sub Class
Cresols
Direct Parent
Meta cresols
Alternative Parents
m-Xylenes / P-chlorophenols / Chlorobenzenes / 1-hydroxy-2-unsubstituted benzenoids / Aryl chlorides / Organooxygen compounds / Organochlorides / Hydrocarbon derivatives
Substituents
1-hydroxy-2-unsubstituted benzenoid / 4-chlorophenol / 4-halophenol / Aromatic homomonocyclic compound / Aryl chloride / Aryl halide / Chlorobenzene / Halobenzene / Hydrocarbon derivative / M-cresol
Molecular Framework
Aromatic homomonocyclic compounds
External Descriptors
phenols, monochlorobenzenes (CHEBI:34393)
Affected organisms
  • Humans and other mammals

Chemical Identifiers

UNII
0F32U78V2Q
CAS number
88-04-0
InChI Key
OSDLLIBGSJNGJE-UHFFFAOYSA-N
InChI
InChI=1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3
IUPAC Name
4-chloro-3,5-dimethylphenol
SMILES
CC1=CC(O)=CC(C)=C1Cl

References

General References
  1. McDonnell G, Russell AD: Antiseptics and disinfectants: activity, action, and resistance. Clin Microbiol Rev. 1999 Jan;12(1):147-79. [Article]
  2. Judis J: Binding of selected phenol derivatives to human serum proteins. J Pharm Sci. 1982 Oct;71(10):1145-7. [Article]
  3. ZONDEK B, FINKELSTEIN M: Blood concentration of P-chloro-xylenol in man following parenteral, percutaneous and rectal application. Proc Soc Exp Biol Med. 1946 Feb;61:200-2. [Article]
  4. Zondek B, Shapiro B: Fate of halogenated phenols in the organism. Biochem J. 1943;37(5):592-5. [Article]
  5. US EPA Reregistration Eligibility Decision (RED): Chloroxylenol [Link]
  6. Exponent FDA Consumer Antispetics Rule: FDA Request for Data on Safety and Efficacy of Chloroxylenol [Link]
  7. Electronic Medicines Compendium: Dettol (Chloroxylenol) Antiseptic Cream Monograph [Link]
  8. NLM Toxnet: Chloroxylenol [Link]
  9. Electronic Medicines Compendium: Dettol (chloroxylenol) Liquid Monograph [Link]
KEGG Drug
D03473
KEGG Compound
C14715
PubChem Compound
2723
PubChem Substance
347827904
ChemSpider
21106017
BindingDB
50238619
RxNav
20877
ChEBI
34393
ChEMBL
CHEMBL398440
ZINC
ZINC000000001132
Wikipedia
Chloroxylenol
MSDS
Download (47.9 KB)

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount
4CompletedPreventionSkin Health1
2CompletedTreatmentCystic Fibrosis (CF)1
Not AvailableUnknown StatusPreventionArthroscopic Rotator Cuff Repair / Cutibacterium Acnes1

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
FormRouteStrength
KitOphthalmic; Oral; Respiratory (inhalation); Topical
Cream; gel; kit; liquid; ointment; spray; swabOphthalmic; Topical
KitOphthalmic; Respiratory (inhalation); Topical
Gel; kit; liquid; ointment; swab; tabletOral; Topical
JellyTopical
SoapTopical1 g/100mL
LiquidTopical2.1 mL/100mL
LiquidTopical1.49 %
LotionTopical1.0 %
SoapTopical0.005 mL/1mL
LiquidTopical15 mg/1mL
SoapTopical15 g/1000mL
SolutionTopical1.5 g/100mL
GelTopical0.01 mg/1mL
LiquidTopical.3 mg/1mL
LiquidTopical0.5 %
LiquidTopical3.09 mg/1mL
LiquidTopical6.046 g/1L
SoapTopical40 g/1kg
SoapTopical.3 g/100g
SoapTopical5 mL/1000mL
GelTopical1.0 % w/w
SoapTopical6.10 g/1L
SoapTopical4 g/1000mL
LiquidTopical
LiquidTopical2.5 mg/1mL
EmulsionTopical0.5 % v/v
GelTopical10 mg/1mL
GelTopical0.3 g/100mL
GelTopical4 mL/800mL
LotionTopical3.6 mg/800mL
SoapTopical6.0 mg/1000mL
Liquid; soapTopical.6 %
GelTopical0.75 g/100mL
SoapTopical0.45 g/100mL
SoapTopical10.11 g/1L
LotionTopical0.6 %
OintmentTopical1.5 mg / g
LotionTopical0.5 % w/w
LiquidTopical0.5 g/100mL
SoapTopical0.3 mg/100mL
SoapTopical25 g/100g
OintmentTopical8 mg / mL
SolutionTopical30 mg/1mL
SolutionTopical3.0 %
SolutionTopical4.8 % w/v
LiquidTopical1.25 g/500mL
CreamTopical.25 %
SoapCutaneous0.1 g/100g
SoapTopical0.282 mg/100mL
LiquidTopical13 kg/100kg
LiquidTopical0.3 mg/1mL
SoapTopical0.10 g/100mL
SoapTopical0.1 g/100mL
SoapTopical15 g/1L
SolutionTopical0.6 mg/100mL
SoapTopical10.1 mg/1mL
SoapTopical5 mg/0.001L
LiquidTopical0.507 g/100mL
SoapTopical5 mg/1mL
LiquidTopical0.75 mg/100mL
LiquidTopical7.5 mg/1mL
SoapTopical0.003 g/1mL
LiquidTopical3 kg/100kg
LiquidTopical5 %
LotionTopical
LiquidTopical0.305 g/100mL
LiquidTopical0.00375 mg/1mL
Kit; shampoo; soapTopical
LiquidTopical5 mg/100mL
SoapTopical0.5 g/100mL
ShampooTopical
LiquidTopical4 mg/1mL
Lotion; soapTopical.5 %
LiquidTopical0.95 g/100mL
SoapTopical0.002 g/1mL
LiquidTopical.6 %
SolutionTopical4.8 %
LiquidTopical10 %
Liquid
LiquidCutaneous4.8 g/15mL
SolutionTopical4.8 g/100mL
SolutionTopical0.6 mL/100mL
LiquidTopical1 g/2L
LiquidTopical0.22 g/100mL
ClothTopical0.2 g/100mL
LiquidTopical0.15 g/100mL
SpongeTopical3 %
LiquidTopical3 g/1L
LiquidTopical1.1 %
SolutionTopical9 mg/1mL
SolutionTopical1.0 mg/100mL
SolutionTopical100 mg/1mL
SolutionTopical5.20 mg/1mL
SolutionTopical0.8 mg/100mL
LotionTopical0.25 %
SolutionTopical8 mg/1mL
Lotion; soapTopical0.8 %
LiquidTopical15.75 g/1000mL
GelTopical2.5 mg/0.001L
SolutionTopical2.5 mg/1mL
SoapTopical2.5 g/1000mL
SolutionTopical0.50 %
CreamTopical
SolutionCutaneous
SoapTopical2 g/100L
SolutionTopical10 mg/1mL
SoapTopical4.5 mg/1mL
Aerosol, foamTopical
LiquidTopical0.015 g/100mL
LotionTopical.5 %
SoapTopical2.5 mg/0.001L
GelTopical3 mg/1mL
LiquidTopical0.01 mg/1mL
LiquidTopical.05 mg/1mL
SolutionTopical0.3 g/100mL
LiquidTopical0.50 %
Cream
SoapTopical2.5 mg/1mL
SoapTopical0.6 g/100mL
LiquidTopical0.663 g/221mL
LiquidTopical0.5 g/100g
SoapTopical3 mg/1mL
LiquidTopical3.5 g/100mL
LiquidTopical0.003 mg/1mL
LiquidTopical0.50 g/100mL
LiquidTopical1.50 g/100mL
LotionTopical10.22 g/1000mL
Solution / dropsAuricular (otic)
GelTopical0.5 % w/w
LiquidTopical; Vaginal
LiquidTopical3 mg/0.001L
GelTopical5 mg/1mL
SoapTopical3 g/1000mL
SoapTopical3 mg/1g
SoapTopical0.75 g/100mL
SolutionTopical1.75 % w/w
SolutionTopical17.5 g/1L
SolutionTopical0.0175 L/1L
SolutionTopical0.0175 g/1mL
Aerosol, foamTopical0.005 g/1mL
LiquidTopical10.22 g/1000mL
GelTopical0.05 g/59g
SolutionTopical0.5 mg/100mL
SolutionTopical4.8 %w/v
SoapTopical0.1 g/1L
LiquidTopical5 mg/1mL
GelTopical0.95 g/1g
LiquidTopical6 mg/1mL
SoapTopical0.95 g/100mL
SolutionTopical6.12 mg/1mL
ClothTopical
SwabTopical
LiquidTopical0.30 g/100g
LiquidTopical0.3 %
SolutionTopical
GelTopical0.015 g/100mL
GelTopical
LotionTopical.25 %
LiquidTopical.5 %
LiquidAuricular (otic)
ClothTopical0.5 %
SoapTopical2.5 mg/1g
GelTopical2.5 mg/1mL
SoapTopical25 g/1000mL
SpongeTopical33 mg/1mL
SpongeTopical40 mg/1mL
SolutionTopical3.3 mg/100mL
SoapTopical0.005 g/1mL
SoapTopical0.1 g/100g
LiquidTopical0.3 g/100mL
LiquidTopical0.6657 mg/221.8mL
LiquidTopical1.5 %
SolutionTopical0.6 % w/w
LiquidTopical3 mg/1mL
SolutionTopical0.525 % w/w
LiquidTopical0.5 mg/100mL
LiquidTopical.25 %
LiquidTopical0.30 kg/100kg
LotionTopical.6 %
SolutionTopical6 mg/1mL
SoapTopical0.3 g/100mL
LiquidTopical0.5 mL/100mL
SolutionTopical5 mg/1mL
SolutionTopical5.2 mg/1mL
SolutionTopical5.25 mg/1mL
LotionTopical.3 %
LiquidTopical0.005 mg/1mL
SolutionTopical0.005 mg/1mL
SoapTopical0.2 g/100mL
SoapTopical6 mg/1mL
LiquidTopical2.949 g/100mL
LiquidTopical3 mL/100mL
LiquidTopical3 % w/v
LiquidTopical0.8 mL/100mL
LotionTopical0.08 mg/100mL
OintmentTopical
GelTopical1 %
LotionTopical3.0 g/100mL
SoapTopical30 mg/10mL
LiquidTopical.7 %
SoapTopical5 g/1000mL
LiquidTopical0.3 mg/100mL
GelTopical0.5 g/100g
GelTopical0.3 g/100g
SoapTopical4 mg/1mL
LiquidTopical0.1 g/100mL
LiquidTopical0.0060 mg/1mL
LiquidTopical0.0060 g/1mL
SolutionTopical0.5 g/100mL
SolutionTopical0.5 % w/w
SolutionTopical1.75 %
SolutionTopical1.25 g/100mL
SolutionTopical1.25 %
LiquidTopical1.75 %
SolutionTopical33 mg/1mL
SolutionTopical40 mg/1mL
SolutionTopical3.3 %
SolutionTopical4 mg/100mL
LotionTopical0.5 %
Aerosol, foamTopical.5 mL/100mL
LotionTopical0.3 %
LiquidTopical0.6 g/100mL
LiquidTopical5 g/1L
Aerosol, foamTopical5 mg/1mL
SoapTopical0.33 mg/1000mL
LiquidTopical1.0 %
AerosolTopical.1 %
SoapTopical10 mg/1mL
SolutionTopical3.82 g/100mL
LiquidTopical0.3 mL/100mL
LiquidTopical1 g/100mL
LiquidTopical1 % w/w
SolutionTopical10 g/1L
SolutionTopical1 g/100mL
LotionTopical0.51 %
SoapTopical0.001 mg/100mL
LiquidTopical1 %
LiquidTopical12.604 g/100mL
LiquidTopical10 g/1000mL
LiquidTopical10 mg/1mL
SolutionTopical0.3 mg/1mL
SoapTopical3 %
LiquidTopical3 %
SoapTopical0.03 g/100mL
SolutionTopical0.5 %
GelTopical.25 %
LiquidTopical2 %
GelTopical2 mg/1mL
LiquidTopical0.05 g/100mL
SoapTopical2.75 g/100mL
SolutionTopical2.75 % w/w
LiquidTopical2.75 g/100mL
LiquidTopical0.3 kg/100kg
LotionTopical1 %
SoapTopical3.75 mg/1mL
SoapTopical0.75 g/100g
LiquidTopical50 g/1L
SoapTopical3.6 g/1mL
LiquidTopical3.09 g/1mL
LiquidTopical3.06 mg/1mL
LiquidTopical1 g/1L
GelTopical0.52 g/100mL
SolutionTopical0.52 %
GelTopical0.5 %
ClothTopical0.5 g/100g
LiquidTopical0.6 %
LiquidTopical0.65 %
SolutionTopical0.5 % v/v
SolutionTopical1.2 g/240mL
SolutionTopical
SoapTopical2.5 g/1L
SoapTopical1 g/1L
SoapTopical1 g/100g
SoapTopical7.5 mg/1mL
SoapTopical5.0 mg/1mL
LiquidTopical2081980 mg/208198mL
SoapTopical.5 %
SoapTopical
LiquidTopical3 g/100mL
LiquidTopical0.4 g/100mL
LiquidTopical0.04 g/10L
LiquidTopical0.3 g/10mL
Liquid; shampooTopical
Prices
Not Available
Patents
Not Available

Properties

State
Liquid
Experimental Properties
PropertyValueSource
melting point (°C)112-116 degrees CelsiusMSDS
boiling point (°C)246 degrees CelsiusMSDS
water solubility0.03 g/100ml at 15 degrees Celsius, 0.5 g/100ml at 100 degrees CelsiusMSDS
Predicted Properties
PropertyValueSource
Water Solubility0.855 mg/mLALOGPS
logP3.14ALOGPS
logP3.3Chemaxon
logS-2.3ALOGPS
pKa (Strongest Acidic)9.21Chemaxon
pKa (Strongest Basic)-6.3Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count1Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area20.23 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity42.93 m3·mol-1Chemaxon
Polarizability16.04 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Mass Spectrum (Electron Ionization)MSsplash10-05fu-9500000000-8bba3165beb98d883986
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSNot Available
1H NMR Spectrum1D NMRNot Applicable
13C NMR Spectrum1D NMRNot Applicable

Drug created at December 03, 2015 16:51 / Updated at March 22, 2023 23:54