Vitas-M small molecule compound

2,2-dimethyl-5-(thiophen-2-ylmethylidene)-1,3-dioxane-4,6-dione

Catalog ID
STK045606
SMILES O=C1OC(C)(C)OC(=O)C1=Cc1cccs1

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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 C11H10O4S MW 238.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10O4S/c1-11(2)14-9(12)8(10(13)15-11)6-7-4-3-5-16-7/h3-6H,1-2H3
InChIKey
NUWFXIJTIAJXML-UHFFFAOYSA-N
Synonyms
15875-50-0
15875500
22DDMETHYL5(2THENYLIDENE)13DIOXANE46DIONE
22DIMETHYL5(2THIENYLMETHYLENE)13DIOXANE46DIONE
22DIMETHYL5(THIOPHEN2YLMETHYLENE)13DIOXANE46DIONE
22DIMETHYL5(THIOPHEN2YLMETHYLIDENE)13DIOXANE46DIONE
22DIMETHYL5THIOPHEN2YLMETHYLENE(13)DIOXANE46DIONE
CC1(OC(=O)C(=CC2=CC=CS2)C(=O)O1)C
InChI=1SC11H10O4Sc111(2)149(12)8(10(13)1511)67435167h36H12H3
MFCD00106876
O=C1OC(C)(C)OC(=O)C1=Cc1cccs1
STK045606
ZINC000000119010
ZINC00119010
ZINC119010

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Available files

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