Basic information
- CAS
27068-07-1- Standard SMILES
CC[N+](CC)(CC)c1cccc(O)c1.[Br-]- InChIKey
TVKWFYUSFZSPTC-UHFFFAOYSA-N- Molecular formula
- C12H20BrNO
- Average molar mass
- 274.2 g/mol
- Monoisotopic mass
- 273.07283
Names & identifiers
- Preferred name
- 3-(Triethylazaniumyl)phenolate--hydrogen bromide (1/1)
- IUPAC
- triethyl-(3-hydroxyphenyl)azanium bromide
Names & synonyms
DTXSID809498223-(Triethylazaniumyl)phenolate--hydrogen bromide (1/1)RefChem:1067242DTXCID40137800227068-07-1(3-Hydroxyphenyl)triethylammonium bromideRo 2-3709AMMONIUM, (3-HYDROXYPHENYL)TRIETHYL-, BROMIDE
Database identifiers
- CAS
27068-07-1- PubChem CID
- 33681
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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