Vitas-M small molecule compound

2-(3,4-dimethoxyphenyl)-2-oxoethyl thiocyanate

Catalog ID
STK734292
SMILES N#CSCC(=O)c1ccc(c(c1)OC)OC

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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 C11H11NO3S MW 237.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO3S/c1-14-10-4-3-8(5-11(10)15-2)9(13)6-16-7-12/h3-5H,6H2,1-2H3
InChIKey
WAIJFLLFDYMRFP-UHFFFAOYSA-N
Synonyms
19339-61-8
(2(34DIMETHOXYPHENYL)2OXOETHYL)THIOCARBONITRILE
(2(34DIMETHOXYPHENYL)2OXOETHYL)THIOCYANATE
1(34DIMETHOXYPHENYL)2THIOCYANATOETHANONE
19339618
2(34dimethoxyphenyl)2oxoethylthiocyanate
34DIMETHOXYPHENACYLTHIOCYANATE
COC1=C(C=C(C=C1)C(=O)CSC#N)OC
InChI=1SC11H11NO3Sc11410438(511(10)152)9(13)616712h35H6H212H3
MFCD02853089
ZINC000002812364
ZINC02812364
ZINC2812364

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Available files

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