Vitas-M small molecule compound
(2Z)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-6-[(pentafluorobenzyl)oxy]-1-benzofuran-3(2H)-one
Catalog ID
STK924902
SMILES COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(c2)OCc1c(F)c(F)c(c(c1F)F)F
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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 C25H15F5O4 MW 474.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H15F5O4/c1-32-17-7-3-2-5-13(17)6-4-8-18-25(31)15-10-9-14(11-19(15)34-18)33-12-16-20(26)22(28)24(30)23(29)21(16)27/h2-11H,12H2,1H3/b6-4+,18-8-InChIKey
SXXAAQFLLKUVEU-VDZUBFLMSA-NSynonyms
622793-29-7(2Z)2((2E)3(2methoxyphenyl)prop2en1ylidene)6((pentafluorobenzyl)oxy)1benzofuran3(2H)one
(2Z)2((E)3(2methoxyphenyl)prop2enylidene)6((23456pentafluorophenyl)methoxy)1benzofuran3one
(Z)2((E)3(2methoxyphenyl)allylidene)6((perfluorophenyl)methoxy)benzofuran3(2H)one
622793297
COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=C(C(=C(C(=C4F)F)F)F)F
COc1ccccc1C=CC=C1Oc2c(C1=O)ccc(c2)OCc1c(F)c(F)c(c(c1F)F)F
InChI=1SC25H15F5O4c13217732513(17)6481825(31)1510914(1119(15)3418)33121620(26)22(28)24(30)23(29)21(16)27h211H12H21H3b64+188
MFCD04177941
ZINC000009158084
ZINC09158084
ZINC9158084
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