Vitas-M small molecule compound

methyl [(4-methylbenzyl)sulfanyl]acetate

Catalog ID
STK445760
SMILES COC(=O)CSCc1ccc(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 C11H14O2S MW 210.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14O2S/c1-9-3-5-10(6-4-9)7-14-8-11(12)13-2/h3-6H,7-8H2,1-2H3
InChIKey
BEJDOFKYBKRURF-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)CSCC(=O)OC
InChI=1SC11H14O2Sc193510(649)714811(12)132h36H78H212H3
methyl((4methylbenzyl)sulfanyl)acetate
methyl2((4methylphenyl)methylsulfanyl)acetate
METHYL2((4METHYLPHENYL)METHYLTHIO)ACETATE
MFCD04058372
ZINC000006788295
ZINC06788295
ZINC6788295

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Available files

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