Vitas-M small molecule compound
(2Z,7Z)-2,7-bis(4-butoxybenzylidene)cycloheptanone
Catalog ID
STK754035
SMILES CCCCOc1ccc(cc1)/C=C\1/CCCC/C(=C/c2ccc(cc2)OCCCC)/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 C29H36O3 MW 432.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36O3/c1-3-5-19-31-27-15-11-23(12-16-27)21-25-9-7-8-10-26(29(25)30)22-24-13-17-28(18-14-24)32-20-6-4-2/h11-18,21-22H,3-10,19-20H2,1-2H3/b25-21-,26-22-InChIKey
DXHBHRMCGDUROF-ORFRIDJFSA-NSynonyms
(2Z7Z)27BIS((4BUTOXYPHENYL)METHYLIDENE)CYCLOHEPTAN1ONE
(2Z7Z)27bis(4butoxybenzylidene)cycloheptanone
27BIS((4BUTOXYPHENYL)METHYLENE)CYCLOHEPTAN1ONE
CCCCOC1=CC=C(C=C1)C=C2CCCCC(=CC3=CC=C(C=C3)OCCCC)C2=O
CCCCOc1ccc(cc1)C=C1CCCCC(=Cc2ccc(cc2)OCCCC)C1=O
InChI=1SC29H36O3c135193127151123(121627)21259781026(29(25)30)2224131728(181424)3220642h11182122H3101920H212H3b25212622
MFCD00758180
ZINC000039205039
ZINC39205039
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