Basic information
- CAS
15121-92-3- Standard SMILES
NC(CC(=O)c1ccccc1)C(=O)O- InChIKey
QXRCVKLRAOSZCP-UHFFFAOYSA-N- Molecular formula
- C10H11NO3
- Average molar mass
- 193.2 g/mol
- Monoisotopic mass
- 193.07389321
Overview
Alpha-Amino-beta-benzoylpropionic acid is an aromatic ketone.
Names & identifiers
- Preferred name
- alpha-Amino-beta-benzoylpropionic acid
- IUPAC
- 2-amino-4-oxo-4-phenylbutanoic acid
- English name
- alpha-Amino-beta-benzoylpropionic acid
- Molecular formula
- C10H11NO3
- Molecular weight
- 193.2
Names & synonyms
2-amino-4-oxo-4-phenylbutanoic acidalpha-Amino-beta-benzoylpropionic acid15121-92-3(3-Arylcarbonyl)-alanineCHEMBL2040644C034502-amino-4-oxo-4-phenyl-butanoic acidBenzenebutanoic acid, alpha-amino-gamma-oxo-AC1L94A6Alanine, 3-benzoyl-Z9JEE8WSU9SureCN2860324
Show more names
SCHEMBL2860324DTXSID60328636CHEBI:1824982-amino-4-oxo-4-phenylbutanoicacidBDBM50623697FCE-27377STL572861AKOS017515992
Database identifiers
- CAS
15121-92-3- PubChem CID
- 412786
- DTXSID
DTXSID60328636- ChEMBL
CHEMBL2040644- ChEBI
CHEBI:182498- UNII
- Z9JEE8WSU9
- Nikkaji
- J2.742.593C
Properties
Computed structural properties
- XLogP
- -2
- Topological polar surface area
- 80.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 221
Chemistry & industry
Suppliers1 total
SYNCHEM-OHG[email protected]
Additional notes
DefinitionChEBI: Alpha-Amino-beta-benzoylpropionic acid is an aromatic ketone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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