3-{[(Benzyloxy)carbonyl]amino}-3-carbamoylpropanoic acid
Basic information
- CAS
2799-12-4- Standard SMILES
NC(=O)C(CC(=O)O)NC(=O)OCc1ccccc1- InChIKey
AXOUDXRCOBYEFV-UHFFFAOYSA-N- Molecular formula
- C12H14N2O5
- Average molar mass
- 266.25 g/mol
- Monoisotopic mass
- 266.09027155
Names & identifiers
- Preferred name
- 3-{[(Benzyloxy)carbonyl]amino}-3-carbamoylpropanoic acid
- IUPAC
- 4-amino-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid
Names & synonyms
64263-86-13-{[(benzyloxy)carbonyl]amino}-3-carbamoylpropanoic acid4-Amino-3-(((benzyloxy)carbonyl)amino)-4-oxobutanoic acid3-([(Benzyloxy)carbonyl]amino)-3-carbamoylpropanoic acid4-amino-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid2799-12-4NSC264085Butanoic acid, (+-)-SCHEMBL6159279AKOS030570974NSC-264085CS-0345644
Show more names
EN300-82158G472324-amino-3-(benzyloxycarbonylamino)-4-oxo-butanoic acidZ12359404974-Amino-3-(((benzyloxy)carbonyl)amino)-4-oxobutanoicacid
Database identifiers
- CAS
2799-12-4- PubChem CID
- 319612
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- 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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