Molecule ID: 22052920

IUPAC Name: (2-hydroxyphenyl) sulfate

Description: The molecule is an organosulfonate oxoanion that is the conjugate base of pyrocatechol sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3. It has a role as a xenobiotic. It is a conjugate base of a pyrocatechol sulfate.

SMILES: O=S(=O)(O)Oc1ccccc1[O-]

SELFIES: [O][=S][=Branch1][C][=O][Branch1][C][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O-1]

InChI: InChI=1S/C6H6O5S/c7-5-3-1-2-4-6(5)11-12(8,9)10/h1-4,7H,(H,8,9,10)/p-1

Molecular Properties:
- Polar Surface Area: 95.0 Ų
- LogP: 0.3