Vitas-M small molecule compound

(4E)-4-(4-methylpent-3-en-1-ylidene)cyclohexane-1,2-dicarboxylic acid

Catalog ID
STK073889
SMILES CC(=CC/C=C/1\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/h4-5,11-12H,3,6-8H2,1-2H3,(H,15,16)(H,17,18)/b10-5+
InChIKey
HDZCYWICCGGCST-BJMVGYQFSA-N
Synonyms

(1S2RE)4(4methylpent3en1ylidene)cyclohexane12dicarboxylicacid
(4E)4(4METHYLPENT3EN1YLIDENE)CYCLOHEXANE12DICARBOXYLICACID
(4E)4(4METHYLPENT3ENYLIDENE)CYCLOHEXANE12DICARBOXYLICACID
CC(=CCC=C1CC(C@@H)((C@@H)(C1)C(=O)O)C(=O)O)C
CC(=CCC=C1CCC(C(C1)C(=O)O)C(=O)O)C
InChI=1SC14H20O4c19(2)435106711(13(15)16)12(810)14(17)18h451112H368H212H3(H1516)(H1718)b105+
MFCD01117625
STK073889
ZINC000002100009
ZINC000005016129

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Available files

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