Basic information
- CAS
32188-23-1- Standard SMILES
CC(=O)OCC[N+](C)(C)Cc1ccccc1.[Br-]- InChIKey
OXWOEKLWKJQYPQ-UHFFFAOYSA-M- Molecular formula
- C13H20BrNO2
- Average molar mass
- 302.21 g/mol
- Monoisotopic mass
- 301.06774
Names & identifiers
- Preferred name
- 2-(Acetyloxy)-N-benzyl-N,N-dimethylethan-1-aminium bromide
- IUPAC
- 2-acetyloxyethyl-benzyl-dimethylazanium bromide
Names & synonyms
32188-23-1DTXSID309540472-(Acetyloxy)-N-benzyl-N,N-dimethylethan-1-aminium bromideRefChem:1061419DTXCID401382081Benzyldimethyl(2-hydroxyethyl)ammonium bromide acetateAcetoxyethyl-dimethylbenzylammonium bromideAMMONIUM, BENZYLDIMETHYL(2-HYDROXYETHYL)-, BROMIDE, ACETATE
Database identifiers
- CAS
32188-23-1- PubChem CID
- 36079
- DTXSID
DTXSID30954047
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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