Vitas-M small molecule compound

methyl 4-{[(4-methylphenyl)sulfonyl]methyl}benzoate

Catalog ID
STK183791
SMILES COC(=O)c1ccc(cc1)CS(=O)(=O)c1ccc(cc1)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H16O4S MW 304.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16O4S/c1-12-3-9-15(10-4-12)21(18,19)11-13-5-7-14(8-6-13)16(17)20-2/h3-10H,11H2,1-2H3
InChIKey
IGDVZIOEOVDTOH-UHFFFAOYSA-N
Synonyms
117687-51-1
117687511
4(TOSYLMETHYL)BENZOICACIDMETHYLESTER
CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)OC
InChI=1SC16H16O4Sc1123915(10412)21(1819)11135714(8613)16(17)202h310H11H212H3
METHYL4(((4METHYLPHENYL)SULFONYL)METHYL)BENZOATE
METHYL4((4METHYLPHENYL)SULFONYLMETHYL)BENZOATE
MFCD04079727
ZINC000000566893
ZINC00566893
ZINC566893

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.