Dimethyl(2-hydroxyethyl)octylammonium bromide benzilate

Base Information

• Chemical Name: Dimethyl(2-hydroxyethyl)octylammonium bromide benzilate
• CAS No.: 2019-14-9
• Molecular Formula: C26H38 N O3 . Br
• Molecular Weight: 492.56
• European Community (EC) Number: 217-961-9
• UNII: 21K1P843E6
• DSSTox Substance ID: DTXSID80942252
• Wikidata: Q27253561
• Mol file: 2019-14-9.mol

Synonyms:2019-14-9;EINECS 217-961-9;octibenzonium bromide;UNII-21K1P843E6;Dimethyl(2-hydroxyethyl)octylammonium bromide benzilate;(2-Benziloxyethyl)dimethyloctylammonium bromide;21K1P843E6;Ammonium, dimethyl(2-hydroxyethyl)octyl-, bromide, benzilate;(2-Hydroxyethyl)dimethyloctylammonium bromide, benzilate ester;Benzilsaeure-dimethyl-octyl-ammonium-aethylester bromide [German];Benzilsaeure-dimethyl-octyl-ammonium-aethylester bromide;(2-(Hydroxydiphenylacetoxy)ethyl)dimethyloctylammonium bromide;[2-[hydroxydiphenylacetoxy]ethyl]dimethyloctylammonium bromide;C26H38NO3.Br;C26-H38-N-O3.Br;DTXSID80942252;OCTIBENZONIUM BROMIDE [WHO-DD];LS-17779;Q27253561;1-Octanaminium, N-[2-[(hydroxydiphenylacetyl)oxy]ethyl]-N,N-dimethyl-, bromide;BENZILIC ACID, ESTER WITH (2-HYDROXYETHYL)DIMETHYLOCTYLAMMONIUM BROMIDE;N-(2-{[Hydroxy(diphenyl)acetyl]oxy}ethyl)-N,N-dimethyloctan-1-aminium bromide

Chemical Property of Dimethyl(2-hydroxyethyl)octylammonium bromide benzilate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 14
• Exact Mass: 491.20351
• Heavy Atom Count: 31
• Complexity: 461

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]