Molecule ID: 6433207

IUPAC Name: (2R)-2-amino-3-[(Z)-1,2-dichloroethenyl]sulfanylpropanoic acid

Description: The molecule is an L-alpha-amino acid that is L-cysteine in which the hydrogen attached to the sulfur is replaced by a 1,2-dichlorovinyl group. It is an organochlorine compound, a monocarboxylic acid, a L-cysteine thioether and a non-proteinogenic L-alpha-amino acid.

SMILES: N[C@@H](CS/C(Cl)=C/Cl)C(=O)O

SELFIES: [N][C@@H1][Branch1][=Branch2][C][S][/C][Branch1][C][Cl][=C][/Cl][C][=Branch1][C][=O][O]

InChI: InChI=1S/C5H7Cl2NO2S/c6-1-4(7)11-2-3(8)5(9)10/h1,3H,2,8H2,(H,9,10)/b4-1+/t3-/m0/s1

Molecular Properties:
- Polar Surface Area: 88.6 Ų
- LogP: -1.1