Basic information
- CAS
63977-52-6- Standard SMILES
Cc1cc(C)c([N+](C)(C)C)cc1O.[Br-]- InChIKey
MKHNHUAKANLVLX-UHFFFAOYSA-N- Molecular formula
- C11H18BrNO
- Average molar mass
- 260.17 g/mol
- Monoisotopic mass
- 259.05718
Names & identifiers
- Preferred name
- Ammonium, (2,4-dimethyl-5-hydroxyphenyl)trimethyl-, bromide
- IUPAC
- (5-hydroxy-2,4-dimethylphenyl)-trimethylazanium bromide
Names & synonyms
63977-52-6AMMONIUM, (2,4-DIMETHYL-5-HYDROXYPHENYL)TRIMETHYL-, BROMIDERefChem:1076693Ro 2-3582(2,4-Dimethyl-5-hydroxyphenyl)trimethylammonium bromide
Database identifiers
- CAS
63977-52-6- PubChem CID
- 45796
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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