Vitas-M small molecule compound
(4E,8E)-4,8-bis(4-chlorobenzylidene)-1-oxaspiro[2.5]octane
Catalog ID
STK993576
SMILES Clc1ccc(cc1)/C=C/1\CCC/C(=C\c2ccc(cc2)Cl)/C21CO2
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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 C21H18Cl2O MW 357.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2O/c22-19-8-4-15(5-9-19)12-17-2-1-3-18(21(17)14-24-21)13-16-6-10-20(23)11-7-16/h4-13H,1-3,14H2/b17-12+,18-13+InChIKey
XRNIJGTWGQRMME-PWDIZTEBSA-NSynonyms
(4E8E)48bis((4chlorophenyl)methylidene)1oxaspiro(25)octane
(4E8E)48bis(4chlorobenzylidene)1oxaspiro(25)octane
C1CC(=CC2=CC=C(C=C2)Cl)C3(CO3)C(=CC4=CC=C(C=C4)Cl)C1
Clc1ccc(cc1)C=C1CCCC(=Cc2ccc(cc2)Cl)C21CO2
InChI=1SC21H18Cl2Oc22198415(5919)121721318(21(17)142421)131661020(23)11716h413H1314H2b1712+1813+
MFCD18184905
ZINC000051330045
ZINC51330045
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