Cetrimonium hydroxideProduct ingredient for Cetrimonium
- Name
- Cetrimonium hydroxide
- Drug Entry
- Cetrimonium
Cetrimonium is a quaternary ammonium cation whose salts are used as antiseptics.
- Accession Number
- DBSALT001771
- Structure
- Synonyms
- Not Available
- UNII
- 8Q7D6895LV
- CAS Number
- 505-86-2
- Weight
- Average: 301.559
Monoisotopic: 301.334465009 - Chemical Formula
- C19H43NO
- InChI Key
- WJLUBOLDZCQZEV-UHFFFAOYSA-M
- InChI
- InChI=1S/C19H42N.H2O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H2/q+1;/p-1
- IUPAC Name
- hexadecyltrimethylazanium hydroxide
- SMILES
- [OH-].CCCCCCCCCCCCCCCC[N+](C)(C)C
- External Links
- ChemSpider
- 61474
- Predicted Properties
Property Value Source Water Solubility 2.93e-05 mg/mL ALOGPS logP 2.74 ALOGPS logP 2.69 Chemaxon logS -7 ALOGPS Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 15 Chemaxon Refractivity 104.99 m3·mol-1 Chemaxon Polarizability 41.09 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