Vitas-M small molecule compound

3,3,5-trimethylcyclohex-4-ene-1,2-dicarboxylic acid

Catalog ID
STK662420
SMILES OC(=O)C1CC(=CC(C1C(=O)O)(C)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 C11H16O4 MW 212.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H16O4/c1-6-4-7(9(12)13)8(10(14)15)11(2,3)5-6/h5,7-8H,4H2,1-3H3,(H,12,13)(H,14,15)
InChIKey
FXRAOARZHSCPPN-UHFFFAOYSA-N
Synonyms
91352-96-4
335TRIMETHYL4CYCLOHEXENE12DICARBOXYLICACID
335trimethylcyclohex4ene12dicarboxylicacid
91352964
CC1=CC(C(C(C1)C(=O)O)C(=O)O)(C)C
InChI=1SC11H16O4c1647(9(12)13)8(10(14)15)11(23)56h578H4H213H3(H1213)(H1415)
MFCD00452160
ZINC000000054321
ZINC000000054324

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Available files

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