Molecule ID: 25244088

IUPAC Name: 2-azaniumylethanesulfinate

Description: The molecule is zwitterionic form of hypotaurine arising from migration of a proton from the sulfonate group to the amino group; major species at pH 7.3. It is a conjugate acid of a hypotaurine(1-). It is a tautomer of a hypotaurine.

SMILES: NCCS(=O)O

SELFIES: [N][C][C][S][=Branch1][C][=O][O]

InChI: InChI=1S/C2H7NO2S/c3-1-2-6(4)5/h1-3H2,(H,4,5)

Molecular Properties:
- Polar Surface Area: 87.0 Ų
- LogP: -2.1