Molecule ID: 5287866

IUPAC Name: (2S)-2-azaniumyl-3-chloropropanoate

Description: The molecule is zwitterionic form of 3-chloro-D-alanine having an anionic carboxy group and a protonated amino group; major species at pH 7.3. It is an amino acid zwitterion and an organochlorine compound. It is a tautomer of a 3-chloro-D-alanine.

SMILES: N[C@H](CCl)C(=O)O

SELFIES: [N][C@H1][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)/t2-/m1/s1

Molecular Properties:
- Polar Surface Area: 67.8 Ų
- LogP: -2.1