methanesulfonic acid; 4-methylbenzenesulfonic acid

Systemtic Name: methanesulfonic acid; 4-methylbenzenesulfonic acid Openeye Name: methanesulfonic acid; 4-methylbenzenesulfonic acid CAS Name: methanesulfonic acid; 4-methylbenzenesulfonic acid IUPAC Name: methanesulfonic acid; 4-methylbenzenesulfonic acid Traditional Name: mesylic acid; tosylic acid Formula: C8H12O6S2 MolecularWeight: 268.30728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CS(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C7H8O3S.CH4O3S/c1-6-2-4-7(5-3-6)11(8,9)10;1-5(2,3)4/h2-5H,1H3,(H,8,9,10);1H3,(H,2,3,4)