Benzododecinium bromideProduct ingredient for Benzododecinium
- Name
- Benzododecinium bromide
- Drug Entry
- Benzododecinium
Benzododecinium is used as an antiseptic/disinfectant compound. It has been marketed as a tincture for antiseptic product for wounds in the Czech Republic.
- Accession Number
- DBSALT003165
- Structure
- Synonyms
- Lauralkonium bromide
- External IDs
- Caswell No. 416B
- UNII
- IRY12B2TQ6
- CAS Number
- 7281-04-1
- Weight
- Average: 384.446
Monoisotopic: 383.218763 - Chemical Formula
- C21H38BrN
- InChI Key
- KHSLHYAUZSPBIU-UHFFFAOYSA-M
- InChI
- InChI=1S/C21H38N.BrH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1
- IUPAC Name
- benzyl(dodecyl)dimethylazanium bromide
- SMILES
- [Br-].CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
- External Links
- ChemSpider
- 22165
- ChEMBL
- CHEMBL2355417
- Wikipedia
- Benzododecinium_bromide
- Predicted Properties
Property Value Source logP 2.63 Chemaxon pKa (Strongest Acidic) 18.11 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 13 Chemaxon Refractivity 111.2 m3·mol-1 Chemaxon Polarizability 41.48 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon