Vitas-M small molecule compound

2-butyl-5-(4-ethoxy-3-methoxybenzylidene)-2-methyl-1,3-dioxane-4,6-dione

Catalog ID
STK003332
SMILES CCCCC1(C)OC(=O)/C(=C/c2ccc(c(c2)OC)OCC)/C(=O)O1

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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 C19H24O6 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24O6/c1-5-7-10-19(3)24-17(20)14(18(21)25-19)11-13-8-9-15(23-6-2)16(12-13)22-4/h8-9,11-12H,5-7,10H2,1-4H3/b14-11-
InChIKey
SXGRHXXHZODSCX-KAMYIIQDSA-N
Synonyms
2butyl5(4ethoxy3methoxybenzylidene)2methyl13dioxane46dione
CCCCC1(C)OC(=O)C(=Cc2ccc(c(c2)OC)OCC)C(=O)O1
Registry IDs
MFCD02637179
ZINC000002971034

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Available files

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