Vitas-M small molecule compound

4'-pentyl-1,1'-bi(cyclohexyl)-4-carboxylic acid

Catalog ID
STK046539
SMILES CCCCCC1CCC(CC1)C1CCC(CC1)C(=O)O

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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 C18H32O2 MW 280.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H32O2/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(13-11-16)18(19)20/h14-17H,2-13H2,1H3,(H,19,20)
InChIKey
VRPANQODGRNWRV-UHFFFAOYSA-N
Synonyms

(1R4R)4PENTYL(11BI(CYCLOHEXANE))4CARBOXYLICACID
(TRANSTRANS)4PENTYL(11BICYCLOHEXYL)4CARBOXYLICACID
4(4PENTYLCYCLOHEXYL)CYCLOHEXANE1CARBOXYLICACID
4(4PENTYLCYCLOHEXYL)CYCLOHEXANECARBOXYLICACID
4BETAPENTYL1BETA1BETABICYCLOHEXANE4ALPHACARBOXYLICACID
4PENTYL(11BI(CYCLOHEXANE))4CARBOXYLICACID
4PENTYL11BI(CYCLOHEXYL)4CARBOXYLICACID
4PENTYLBICYCLOHEXYL4CARBOXYLICACID
CCCCCC1CCC(CC1)C1CCC(CC1)C(=O)O
CCCCCC1CCC(CC1)C2CCC(CC2)C(=O)O
InChI=1SC18H32O2c12345146815(9714)16101217(131116)18(19)20h1417H213H21H3(H1920)
MFCD00600458
STK046539
TRANS4(TRANS4PENTYLCYCLOHEXYL)CYCLOHEXANECARBOXYLICACID
TRANS4(TRANS4PENTYLCYCLOHEXYL)CYCLOHEXYLCARBOXYLICACID
TRANS4PENTYL(11BICYCLOHEXYL)4CARBOXYLICACID
TRANS4PENTYL4CARBOXYLICACID
TRANS4PENTYLBIS(CYCLOHEXANE)CARBOXYLICACID
ZINC000002022829
ZINC100007965
ZINC100050843
ZINC2022829

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Available files

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