1-(4-methylphenyl)propane-1-sulfonic acid

Systemtic Name: 1-(4-methylphenyl)propane-1-sulfonic acid Openeye Name: 1-(p-tolyl)propane-1-sulfonic acid CAS Name: 1-(4-methylphenyl)-1-propanesulfonic acid IUPAC Name: 1-(4-methylphenyl)propane-1-sulfonic acid Traditional Name: 1-(p-tolyl)propane-1-sulfonic acid Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)S(=O)(=O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)S(=O)(=O)O

InChI

InChI=1S/C10H14O3S/c1-3-10(14(11,12)13)9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3,(H,11,12,13)