This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- 2-octyl cyanoacrylate
- DrugBank Accession Number
- DB12040
- Background
Dermabond has been investigated for the basic science of Wound Healing.
- Type
- Small Molecule
- Groups
- Investigational
- Structure
Structure for 2-octyl cyanoacrylate (DB12040)
- Weight
- Average: 209.289
Monoisotopic: 209.141578856 - Chemical Formula
- C12H19NO2
- Synonyms
- 1-methylheptyl cyanoacrylate
- 2-octylcyanoacrylate
- Liquid bandage
Pharmacology
- Indication
Not Available
Reduce drug development failure ratesBuild, train, & validate machine-learning modelswith evidence-based and structured datasets.Build, train, & validate predictive machine-learning models with structured datasets.- Contraindications & Blackbox Warnings
Prevent Adverse Drug Events TodayTap into our Clinical API for life-saving information on contraindications & blackbox warnings, population restrictions, harmful risks, & more.Avoid life-threatening adverse drug events with our Clinical API- Pharmacodynamics
Not Available
- Mechanism of action
- Not Available
- Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.- Toxicity
Not Available
- 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.Not Available
- Food Interactions
- Not Available
Products
Drug product information from 10+ global regionsOur datasets provide approved product information including:dosage, form, labeller, route of administration, and marketing period.Access drug product information from over 10 global regions.- International/Other Brands
- Dermabond (Ethicon US, LLC.) / Indermil (Connexicon Medical Ltd) / Liquiband / Octylseal (Medline Industries, Inc.)
- Over the Counter Products
Name Dosage Strength Route Labeller Marketing Start Marketing End Region Image Subir Eyelash Cream 9.15 g/10g Topical Dream Polymer 2021-03-30 Not applicable US 
- Unapproved/Other Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image Subir Eyelash 2-octyl cyanoacrylate (9.15 g/10g) Cream Topical Dream Polymer 2021-03-30 Not applicable US
Categories
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as cyanoacrylates. These are organonitrogen compounds containing an acrylic acid ester, which carries a nitrile group. They have the general structure ROC(=O)C(=C)C#N, where R is an organic group.
- Kingdom
- Organic compounds
- Super Class
- Organic acids and derivatives
- Class
- Carboxylic acids and derivatives
- Sub Class
- Carboxylic acid derivatives
- Direct Parent
- Cyanoacrylates
- Alternative Parents
- Nitriles / Monocarboxylic acids and derivatives / Organopnictogen compounds / Organic oxides / Hydrocarbon derivatives / Carbonyl compounds
- Substituents
- Aliphatic acyclic compound / Carbonitrile / Carbonyl group / Cyanoacrylic acid ester / Hydrocarbon derivative / Monocarboxylic acid or derivatives / Nitrile / Organic nitrogen compound / Organic oxide / Organic oxygen compound
- Molecular Framework
- Aliphatic acyclic compounds
- External Descriptors
- Not Available
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- L23GHX71SK
- CAS number
- 133978-15-1
- InChI Key
- CQVWXNBVRLKXPE-UHFFFAOYSA-N
- InChI
- InChI=1S/C12H19NO2/c1-4-5-6-7-8-11(3)15-12(14)10(2)9-13/h11H,2,4-8H2,1,3H3
- IUPAC Name
- octan-2-yl 2-cyanoprop-2-enoate
- SMILES
- CCCCCCC(C)OC(=O)C(=C)C#N
References
- General References
- Not Available
- External Links
- PubChem Compound
- 9815689
- PubChem Substance
- 347828351
- ChemSpider
- 7991439
- 2533837
- Wikipedia
- 2-Octyl_cyanoacrylate
Clinical Trials
- Clinical Trials
Phase Status Purpose Conditions Count 4 Recruiting Prevention Gastrocutaneous Fistula / Gastrostomy Complications 1 3 Recruiting Prevention Redundant Prepuce 1 3 Withdrawn Treatment Gynecomastia / Impaired Wound Healing 1 1 Withdrawn Basic Science Promotion of wound healing 1
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
Form Route Strength Cream Topical 9.15 g/10g - Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Not Available
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 0.0244 mg/mL ALOGPS logP 4.1 ALOGPS logP 3.8 Chemaxon logS -3.9 ALOGPS pKa (Strongest Basic) -7.2 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 50.09 Å2 Chemaxon Rotatable Bond Count 8 Chemaxon Refractivity 59.21 m3·mol-1 Chemaxon Polarizability 24.3 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted GC-MS Spectrum - GC-MS Predicted GC-MS splash10-0f89-9100000000-f63857b3e7528e61d27f Predicted MS/MS Spectrum - 10V, Positive (Annotated) Predicted LC-MS/MS splash10-0gx1-9200000000-f615e145ee42dd115b3e Predicted MS/MS Spectrum - 10V, Negative (Annotated) Predicted LC-MS/MS splash10-0a4i-6690000000-f39c69463f52874af864 Predicted MS/MS Spectrum - 20V, Negative (Annotated) Predicted LC-MS/MS splash10-0f6t-9000000000-e1bc3eddbd7911f7ad7d Predicted MS/MS Spectrum - 20V, Positive (Annotated) Predicted LC-MS/MS splash10-0udi-9000000000-aa4105685313b970ec5b Predicted MS/MS Spectrum - 40V, Negative (Annotated) Predicted LC-MS/MS splash10-0udi-9000000000-f4563e0b19e89777636d Predicted MS/MS Spectrum - 40V, Positive (Annotated) Predicted LC-MS/MS splash10-0udi-9100000000-bf6ebf99263ad033bc7b Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 155.9077 predictedDeepCCS 1.0 (2019) [M+H]+ 159.65395 predictedDeepCCS 1.0 (2019) [M+Na]+ 168.69562 predictedDeepCCS 1.0 (2019)
Drug created at October 20, 2016 21:14 / Updated at June 12, 2020 16:53