Molecule ID: 78

IUPAC Name: 2-amino-3-chloropropanoic acid

Description: The molecule is a chloroalanine obtained by replacement of one of the methyl hydrogens of alanine by a chloro group. It is a non-proteinogenic alpha-amino acid, an organochlorine compound and a chloroalanine.

SMILES: NC(CCl)C(=O)O

SELFIES: [N][C][Branch1][Ring1][C][Cl][C][=Branch1][C][=O][O]

InChI: InChI=1S/C3H6ClNO2/c4-1-2(5)3(6)7/h2H,1,5H2,(H,6,7)

Molecular Properties:
- Polar Surface Area: 63.3 Ų
- LogP: -2.8