Basic information
- CAS
63977-53-7- Standard SMILES
Cc1ccc([N+](C)(C)C)c(C)c1O.[Br-]- InChIKey
NSAJZVJLTGQRGE-UHFFFAOYSA-N- Molecular formula
- C11H18BrNO
- Average molar mass
- 260.17 g/mol
- Monoisotopic mass
- 259.05718
Names & identifiers
- Preferred name
- 2,6-Dimethyl-3-(trimethylazaniumyl)phenolate--hydrogen bromide (1/1)
- IUPAC
- (3-hydroxy-2,4-dimethylphenyl)-trimethylazanium bromide
Names & synonyms
63977-53-7DTXSID709814182,6-Dimethyl-3-(trimethylazaniumyl)phenolate--hydrogen bromide (1/1)RefChem:1060268DTXCID501408690Ro 2-3643(2,4-Dimethyl-3-hydroxyphenyl)trimethylammonium bromideAMMONIUM, (2,4-DIMETHYL-3-HYDROXYPHENYL)TRIMETHYL-, BROMIDE
Database identifiers
- CAS
63977-53-7- PubChem CID
- 45798
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 173
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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