Basic information
- CAS
64051-04-3- Standard SMILES
C[N+](C)(C)c1ccccc1O.[Br-]- InChIKey
AOUFQWSQOJRJEW-UHFFFAOYSA-N- Molecular formula
- C9H14BrNO
- Average molar mass
- 232.12 g/mol
- Monoisotopic mass
- 231.02588
Names & identifiers
- Preferred name
- 6-(Trimethyl-lambda~5~-azanylidene)cyclohexa-2,4-dien-1-one--hydrogen bromide (1/1)
- IUPAC
- (2-hydroxyphenyl)-trimethylazanium bromide
Names & synonyms
64051-04-3RefChem:1073759DTXSID80982436DTXCID2014096996-(Trimethyl-lambda~5~-azanylidene)cyclohexa-2,4-dien-1-one--hydrogen bromide (1/1)(2-Hydroxyphenyl)trimethylammonium bromideRo 2-2984AMMONIUM, (o-HYDROXYPHENYL)TRIMETHYL-, BROMIDE2-Hydroxy-N,N,N-trimethylbenzenaminium bromideSCHEMBL1730024
Database identifiers
- CAS
64051-04-3- PubChem CID
- 47056
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 128
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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