Vitas-M small molecule compound
(2E)-3-(4-butoxyphenyl)-1-(5-fluoro-3-methyl-1-benzofuran-2-yl)prop-2-en-1-one
Catalog ID
STK812029
SMILES CCCCOc1ccc(cc1)/C=C/C(=O)c1oc2c(c1C)cc(cc2)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 C22H21FO3 MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FO3/c1-3-4-13-25-18-9-5-16(6-10-18)7-11-20(24)22-15(2)19-14-17(23)8-12-21(19)26-22/h5-12,14H,3-4,13H2,1-2H3/b11-7+InChIKey
BLXRUVRTEIDSFB-YRNVUSSQSA-NSynonyms
(2E)3(4butoxyphenyl)1(5fluoro3methyl1benzofuran2yl)prop2en1one
(E)3(4BUTOXYPHENYL)1(5FLUORO3METHYL1BENZOFURAN2YL)PROP2EN1ONE
CCCCOC1=CC=C(C=C1)C=CC(=O)C2=C(C3=C(O2)C=CC(=C3)F)C
CCCCOc1ccc(cc1)C=CC(=O)c1oc2c(c1C)cc(cc2)F
InChI=1SC22H21FO3c1341325189516(61018)71120(24)2215(2)191417(23)81221(19)2622h51214H3413H212H3b117+
MFCD03510563
ZINC000004320769
ZINC04320769
ZINC4320769
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