Basic information
- CAS
85975-24-2- Standard SMILES
C[NH+](CCC(=O)c1ccc(Br)cc1)CC(=O)O.[Cl-]- InChIKey
TWFVFFVJVSOOPT-UHFFFAOYSA-N- Molecular formula
- C12H15BrClNO3
- Average molar mass
- 336.61 g/mol
- Monoisotopic mass
- 334.99238
Names & identifiers
- Preferred name
- Glycine, N-(3-(4-bromophenyl)-3-oxopropyl)-N-methyl-, hydrochloride
- IUPAC
- [3-(4-bromophenyl)-3-oxopropyl]-(carboxymethyl)-methylazanium chloride
Names & synonyms
GLYCINE, N-(3-(4-BROMOPHENYL)-3-OXOPROPYL)-N-METHYL-, HYDROCHLORIDE85975-24-2RefChem:1086026N-(3-(4-Bromophenyl)-3-oxopropyl)-N-methylglycine hydrochloride
Database identifiers
- CAS
85975-24-2- PubChem CID
- 55448
Properties
Computed structural properties
- Topological polar surface area
- 58.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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