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Vitas-M small molecule compound

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

Catalog ID
STK824454
SMILES O=C1OC(C)(C)OC(=O)C1=Cc1ccc2c(c1)OCO2

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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 C14H12O6 MW 276.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12O6/c1-14(2)19-12(15)9(13(16)20-14)5-8-3-4-10-11(6-8)18-7-17-10/h3-6H,7H2,1-2H3
InChIKey
CDTLWWMBMTUCGU-UHFFFAOYSA-N
Synonyms
87212-59-7
13DIOXANE46DIONE5(13BENZODIOXOL5YLMETHYLENE)22DIMETHYL
22DIMETHYL5(13BENZODIOXOLE5YLMETHYLENE)13DIOXANE46DIONE
5(13BENZODIOXOL5YLMETHYLENE)22DIMETHYL13DIOXANE46DIONE
5(13benzodioxol5ylmethylidene)22dimethyl13dioxane46dione
5(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)22DIMETHYL13DIOXANE46DIONE
5(BENZO(D)(13)DIOXOL5YLMETHYLENE)22DIMETHYL13DIOXANE46DIONE
5BENZO(13)DIOXOL5YLMETHYLENE22DIMETHYL(13)DIOXANE46DIONE
87212597
CC1(OC(=O)C(=CC2=CC3=C(C=C2)OCO3)C(=O)O1)C
InChI=1SC14H12O6c114(2)1912(15)9(13(16)2014)58341011(68)1871710h36H7H212H3
ISOPROPYLIDENE34METHYLENEDIOXYBENZYLIDENEMALONATE
MFCD00128562
ZINC000000041299
ZINC00041299
ZINC41299

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Available files

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