Ammonium, benzyldiethyl(2-hydroxyethyl)-, bromide, carbanilate
Basic information
- CAS
99950-26-2- Standard SMILES
CC[N+](CC)(CCOC(=O)Nc1ccccc1)Cc1ccccc1.[Br-]- InChIKey
KTADIWCOHYZPJN-UHFFFAOYSA-N- Molecular formula
- C20H27BrN2O2
- Average molar mass
- 407.3 g/mol
- Monoisotopic mass
- 406.12559
Names & identifiers
- Preferred name
- Ammonium, benzyldiethyl(2-hydroxyethyl)-, bromide, carbanilate
- IUPAC
- benzyl-diethyl-[2-(phenylcarbamoyloxy)ethyl]azanium bromide
Names & synonyms
Benzyldiethyl(2-hydroxyethyl)ammonium bromide carbanilate1314 HCAMMONIUM, BENZYLDIETHYL(2-HYDROXYETHYL)-, BROMIDE, CARBANILATE99950-26-2RefChem:319164
Database identifiers
- CAS
99950-26-2- PubChem CID
- 57588
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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