Vitas-M small molecule compound

S-(4-methylphenyl) (4-methylphenoxy)ethanethioate

Catalog ID
STK798619
SMILES O=C(Sc1ccc(cc1)C)COc1ccc(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 C16H16O2S MW 272.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16O2S/c1-12-3-7-14(8-4-12)18-11-16(17)19-15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3
InChIKey
CZXIQKHTDKBOPO-UHFFFAOYSA-N
Synonyms

2(4METHYLPHENOXY)1(4METHYLPHENYLTHIO)ETHAN1ONE
CC1=CC=C(C=C1)OCC(=O)SC2=CC=C(C=C2)C
InChI=1SC16H16O2Sc1123714(8412)181116(17)19159513(2)61015h310H11H212H3
MFCD03462022
S(4methylphenyl)(4methylphenoxy)ethanethioate
S(4METHYLPHENYL)2(4METHYLPHENOXY)ETHANETHIOATE
ZINC000000305945
ZINC00305945
ZINC305945

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Available files

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