Basic information
- Standard SMILES
C[C@H](NC(=O)CN)C(=O)OCc1ccccc1.Cl- InChIKey
NUJWOIOHZYWRLY-FVGYRXGTSA-N- Molecular formula
- C12H17ClN2O3
- Average molar mass
- 272.73 g/mol
- Monoisotopic mass
- 272.0927701
Names & identifiers
- Preferred name
- Benzyl glycyl-L-alaninate hydrochloride
- IUPAC
- benzyl (2S)-2-[(2-aminoacetyl)amino]propanoate;hydrochloride
Names & synonyms
63649-09-2H-Gly-Ala-OBzl.HClSCHEMBL11681660NUJWOIOHZYWRLY-FVGYRXGTSA-NBenzyl glycyl-L-alaninate hydrochlorideglycyl-L-alanine benzyl ester hydrochloride
Database identifiers
- PubChem CID
- 53328828
Properties
Computed structural properties
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 262
Related reactions
3 records
Compound notes
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