Vitas-M small molecule compound

4-(4-methylpent-3-en-1-yl)cyclohex-4-ene-1,2-dicarboxylic acid

Catalog ID
STL560987
SMILES CC(=CCCC1=CCC(C(C1)C(=O)O)C(=O)O)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 C14H20O4 MW 252.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20O4/c1-9(2)4-3-5-10-6-7-11(13(15)16)12(8-10)14(17)18/h4,6,11-12H,3,5,7-8H2,1-2H3,(H,15,16)(H,17,18)
InChIKey
IOFGDWLJZRGXRM-UHFFFAOYSA-N
Synonyms
107821-52-3
107821523
3768552
4(4METHYL3PENTENYL)4CYCLOHEXENE12DICARBOXYLICACID
4(4methylpent3en1yl)cyclohex4ene12dicarboxylicacid
4(4METHYLPENT3ENYL)CYCLOHEX4ENE12DICARBOXYLICACID
4CYCLOHEXENE12DICARBOXYLICACID4(4METHYL3PENTENYL)
InChI=1SC14H20O4c19(2)435106711(13(15)16)12(810)14(17)18h461112H3578H212H3(H1516)(H1718)
MFCD01004103
ZINC000000517183
ZINC000004023068

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Available files

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