2-Amino-4-oxo-4-(phenylmethoxycarbonylamino)butanoic acid
Basic information
- CAS
23289-62-5- Standard SMILES
NC(CC(=O)NC(=O)OCc1ccccc1)C(=O)O- InChIKey
WZVYYIARSVMVEE-UHFFFAOYSA-N- Molecular formula
- C12H14N2O5
- Average molar mass
- 266.25 g/mol
- Monoisotopic mass
- 266.09027155
Names & identifiers
- Preferred name
- 2-Amino-4-oxo-4-(phenylmethoxycarbonylamino)butanoic acid
- IUPAC
- 2-amino-4-oxo-4-(phenylmethoxycarbonylamino)butanoic acid
Names & synonyms
NSC136953SCHEMBL6447987YAA43242NSC164668NSC-136953NSC-16466823289-62-5
Database identifiers
- CAS
23289-62-5- PubChem CID
- 282869
Properties
Computed structural properties
- XLogP
- -2.4
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 339
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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