Basic information
- Standard SMILES
NC(=O)CCC(NC(=O)CCl)C(=O)O- InChIKey
LCHLONXFHVEQSU-UHFFFAOYSA-N- Molecular formula
- C7H11ClN2O4
- Average molar mass
- 222.62 g/mol
- Monoisotopic mass
- 222.0407345
Names & identifiers
- Preferred name
- 5-Amino-2-[(2-chloroacetyl)amino]-5-oxopentanoic acid
- IUPAC
- 5-amino-2-[(2-chloroacetyl)amino]-5-oxopentanoic acid
Names & synonyms
SCHEMBL7105398
Database identifiers
- PubChem CID
- 73178334
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 244
Related reactions
2 records
Compound notes
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