Didecyldimethylammonium chlorideProduct ingredient for Didecyldimethylammonium
- Name
- Didecyldimethylammonium chloride
- Drug Entry
- Didecyldimethylammonium
- Accession Number
- DBSALT002532
- Structure
Structure for Didecyldimethylammonium chloride (DBSALT002532)
- Synonyms
- DDAC / Didecyl dimethyl ammonium chloride / Didecyldimethylammonium chlorid / Didecyldimonium chloride / N-decyl-N,N-dimethyl-1-decanaminium chloride / Quaternium-12
- UNII
- JXN40O9Y9B
- CAS Number
- 7173-51-5
- Weight
- Average: 362.08
Monoisotopic: 361.3475282 - Chemical Formula
- C22H48ClN
- InChI Key
- RUPBZQFQVRMKDG-UHFFFAOYSA-M
- InChI
- InChI=1S/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1
- IUPAC Name
- bis(decyl)dimethylazanium chloride
- SMILES
- [Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC
- External Links
- KEGG Compound
- C15436
- ChemSpider
- 22027
- ChEBI
- 79935
- ChEMBL
- CHEMBL224987
- Wikipedia
- Didecyldimethylammonium_chloride
- Predicted Properties
Property Value Source Water Solubility 4.48e-06 mg/mL ALOGPS logP 3.33 ALOGPS logP 4.01 Chemaxon logS -7.9 ALOGPS Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 18 Chemaxon Refractivity 118.86 m3·mol-1 Chemaxon Polarizability 47.18 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon