Vitas-M small molecule compound
(2E)-3-(6-chloro-4H-1,3-benzodioxin-8-yl)-1-(5-fluoro-2-hydroxyphenyl)prop-2-en-1-one
Catalog ID
STK925778
SMILES Clc1cc(/C=C/C(=O)c2cc(F)ccc2O)c2c(c1)COCO2
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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 C17H12ClFO4 MW 334.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClFO4/c18-12-5-10(17-11(6-12)8-22-9-23-17)1-3-15(20)14-7-13(19)2-4-16(14)21/h1-7,21H,8-9H2/b3-1+InChIKey
PIURPIWMOVRWBZ-HNQUOIGGSA-NSynonyms
(2E)3(6CHLORO(2H4HBENZO(E)13DIOXAN8YL))1(5FLUORO2HYDROXYPHENYL)PROP2EN1ONE
(2E)3(6chloro4H13benzodioxin8yl)1(5fluoro2hydroxyphenyl)prop2en1one
(E)3(6CHLORO4H13BENZODIOXIN8YL)1(5FLUORO2HYDROXYPHENYL)PROP2EN1ONE
C1C2=C(C(=CC(=C2)Cl)C=CC(=O)C3=C(C=CC(=C3)F)O)OCO1
Clc1cc(C=CC(=O)c2cc(F)ccc2O)c2c(c1)COCO2
InChI=1SC17H12ClFO4c1812510(1711(612)82292317)1315(20)14713(19)2416(14)21h1721H89H2b31+
MFCD00855484
ZINC000004845478
ZINC04845478
ZINC4845478
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