Vitas-M small molecule compound

(2E,6E)-2,6-bis(2-methoxybenzylidene)cyclohexanone

Catalog ID
STK996966
SMILES COc1ccccc1/C=C/1\CCC/C(=C\c2ccccc2OC)/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 C22H22O3 MW 334.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O3/c1-24-20-12-5-3-8-16(20)14-18-10-7-11-19(22(18)23)15-17-9-4-6-13-21(17)25-2/h3-6,8-9,12-15H,7,10-11H2,1-2H3/b18-14+,19-15+
InChIKey
LFFCQFHMMDURLU-JSAVKQRWSA-N
Synonyms
53376-38-8
(2E6E)26BIS((2METHOXYPHENYL)METHYLIDENE)CYCLOHEXAN1ONE
(2E6E)26bis(2methoxybenzylidene)cyclohexanone
(2Z6E)26bis(2methoxybenzylidene)cyclohexanone
26BIS((2METHOXYPHENYL)METHYLENE)CYCLOHEXAN1ONE
26BIS(2METHOXYBENZYLIDENE)CYCLOHEXANONE
53376388
COC1=CC=CC=C1C=C2CCCC(=CC3=CC=CC=C3OC)C2=O
COc1ccccc1C=C1CCCC(=Cc2ccccc2OC)C1=O
InChI=1SC22H22O3c124201253816(20)14181071119(22(18)23)15179461321(17)252h36891215H71011H212H3b1814+1915+
MFCD00156418
ZINC000004692957
ZINC04692957
ZINC38192727
ZINC4692957

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Available files

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