Vitas-M small molecule compound

(2Z,6Z)-2-(4-methoxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone

Catalog ID
STK103137
SMILES COc1ccc(cc1)/C=C\1/CCC/C(=C(\C(F)(F)F)/O)/C1=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 C16H15F3O3 MW 312.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F3O3/c1-22-12-7-5-10(6-8-12)9-11-3-2-4-13(14(11)20)15(21)16(17,18)19/h5-9,21H,2-4H2,1H3/b11-9-,15-13-
InChIKey
TYOIURGWQCLWEW-CLHOCLAASA-N
Synonyms

(2Z6Z)2(4methoxybenzylidene)6(222trifluoro1hydroxyethylidene)cyclohexanone
COc1ccc(cc1)C=C1CCCC(=C(C(F)(F)F)O)C1=O
MFCD08680067
ZINC000012463578

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Available files

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