Dioctyldimonium chlorideProduct ingredient for Dioctyldimonium
- Name
- Dioctyldimonium chloride
- Drug Entry
- Dioctyldimonium
- Accession Number
- DBSALT002623
- Structure
- Synonyms
- Dimethyl dioctyl ammonium chloride / Dimethyldioctylammonium chloride / Dioctyl dimethyl ammonium chloride / Dioctyldimethylammonium chloride
- External IDs
- HOE-S 2617 / RC 5626
- UNII
- 0X0RL40Y6H
- CAS Number
- 5538-94-3
- Weight
- Average: 305.98
Monoisotopic: 305.284928 - Chemical Formula
- C18H40ClN
- InChI Key
- FARBQUXLIQOIDY-UHFFFAOYSA-M
- InChI
- InChI=1S/C18H40N.ClH/c1-5-7-9-11-13-15-17-19(3,4)18-16-14-12-10-8-6-2;/h5-18H2,1-4H3;1H/q+1;/p-1
- IUPAC Name
- dimethyldioctylazanium chloride
- SMILES
- [Cl-].CCCCCCCC[N+](C)(C)CCCCCCCC
- External Links
- ChemSpider
- 56343
- ChEMBL
- CHEMBL2357351
- Predicted Properties
Property Value Source Water Solubility 7.48e-06 mg/mL ALOGPS logP 1.83 ALOGPS logP 2.23 Chemaxon logS -7.6 ALOGPS Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 14 Chemaxon Refractivity 100.46 m3·mol-1 Chemaxon Polarizability 38.58 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