Vitas-M small molecule compound
(2E)-3-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(4-fluorophenyl)prop-2-en-1-one
Catalog ID
STK694606
SMILES COc1c(/C=C/C(=O)c2ccc(cc2)F)cc2c(c1OC)OCO2
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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 C18H15FO5 MW 330.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15FO5/c1-21-16-12(9-15-17(18(16)22-2)24-10-23-15)5-8-14(20)11-3-6-13(19)7-4-11/h3-9H,10H2,1-2H3/b8-5+InChIKey
JHZCDBATQCAPPM-VMPITWQZSA-NSynonyms
(2E)3(67dimethoxy13benzodioxol5yl)1(4fluorophenyl)prop2en1one
(E)3(67dimethoxy13benzodioxol5yl)1(4fluorophenyl)prop2en1one
3(67DIMETHOXY2H13BENZODIOXOL5YL)1(4FLUOROPHENYL)PROP2EN1ONE
COC1=C(C2=C(C=C1C=CC(=O)C3=CC=C(C=C3)F)OCO2)OC
COc1c(C=CC(=O)c2ccc(cc2)F)cc2c(c1OC)OCO2
InChI=1SC18H15FO5c1211612(91517(18(16)222)24102315)5814(20)113613(19)7411h39H10H212H3b85+
MFCD12034774
ZINC000035325006
ZINC35325006
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