Basic information
- CAS
66967-99-5- Standard SMILES
Cc1cc(O)cc([N+](C)(C)C)c1.[Br-]- InChIKey
WLAJCVWBERTRKP-UHFFFAOYSA-N- Molecular formula
- C10H16BrNO
- Average molar mass
- 246.14 g/mol
- Monoisotopic mass
- 245.04153
Names & identifiers
- Preferred name
- 3-Methyl-5-(trimethylazaniumyl)phenolate--hydrogen bromide (1/1)
- IUPAC
- (3-hydroxy-5-methylphenyl)-trimethylazanium bromide
Names & synonyms
66967-99-5DTXSID609857283-Methyl-5-(trimethylazaniumyl)phenolate--hydrogen bromide (1/1)RefChem:1068260DTXCID401412919(5-Hydroxy-m-tolyl)trimethylammonium bromideRo 2-3907AMMONIUM, (5-HYDROXY-m-TOLYL)TRIMETHYL-, BROMIDE
Database identifiers
- CAS
66967-99-5- PubChem CID
- 48685
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 150
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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