Vitas-M small molecule compound
methyl 5-acetyl-2,2-dimethyl-4,6-dioxocyclohexanecarboxylate
Catalog ID
STK053715
SMILES COC(=O)C1C(=O)C(C(=O)C)C(=O)CC1(C)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 C12H16O5 MW 240.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16O5/c1-6(13)8-7(14)5-12(2,3)9(10(8)15)11(16)17-4/h8-9H,5H2,1-4H3InChIKey
ZFVYHWOVSACDRU-UHFFFAOYSA-NSynonyms
CC(=O)C1C(=O)CC(C(C1=O)C(=O)OC)(C)C
COC(=O)C1C(=O)C(C(=O)C)C(=O)CC1(C)C
InChI=1SC12H16O5c16(13)87(14)512(23)9(10(8)15)11(16)174h89H5H214H3
METHYL5ACETYL22DIMETHYL46DIOXOCYCLOHEXANE1CARBOXYLATE
METHYL5ACETYL22DIMETHYL46DIOXOCYCLOHEXANECARBOXYLATE
MFCD00513047
STK053715
ZINC000000287339
ZINC000100739062
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.