Molecule ID: 85570

IUPAC Name: 4-methylbenzenesulfonate

Description: The molecule is an arenesulfonate oxoanion that is the conjugate base of toluene-4-sulfonic acid. It is a conjugate base of a toluene-4-sulfonic acid.

SMILES: Cc1ccc(S(=O)(=O)[O-])cc1

SELFIES: [C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O-1][C][=C][Ring1][#Branch2]

InChI: InChI=1S/C7H8O3S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H,8,9,10)/p-1

Molecular Properties:
- Polar Surface Area: 65.6 Ų
- LogP: 1.6