Basic information
- CAS
5938-06-7- Standard SMILES
C[N+](C)(C)CC(=O)O.[Br-]- InChIKey
ZCCXZMHMPCCJIG-UHFFFAOYSA-N- Molecular formula
- C5H12BrNO2
- Average molar mass
- 198.06 g/mol
- Monoisotopic mass
- 197.00514
Names & identifiers
- Preferred name
- (Carboxymethyl)trimethylammonium bromide
- IUPAC
- carboxymethyl(trimethyl)azanium bromide
Names & synonyms
(Carboxymethyl)trimethylammonium bromide5938-06-71-Carboxy-N,N,N-trimethylmethanaminium bromideSCHEMBL5051701EINECS 227-695-5AKOS024342284N,N-Trimethyl Ammonio Acetic Acid BromideN-(carboxymethyl)-trimethylammonium bromideNS00082964
Database identifiers
- CAS
5938-06-7- PubChem CID
- 80044
- EC Number
- 227-695-5
Properties
Computed structural properties
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 93.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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