Vitas-M small molecule compound

methyl 2-{[(2Z)-2-(2-fluorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate

Catalog ID
STK992439
SMILES COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccccc1F)/C2=O)C

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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 C19H15FO5 MW 342.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15FO5/c1-11(19(22)23-2)24-13-7-8-14-16(10-13)25-17(18(14)21)9-12-5-3-4-6-15(12)20/h3-11H,1-2H3/b17-9-
InChIKey
XQVWQRMRXOICIY-MFOYZWKCSA-N
Synonyms
623122-86-1
(Z)methyl2((2(2fluorobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
623122861
CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CC=C3F)O2
COC(=O)C(Oc1ccc2c(c1)OC(=Cc1ccccc1F)C2=O)C
InChI=1SC19H15FO5c111(19(22)232)2413781416(1013)2517(18(14)21)912534615(12)20h311H12H3b179
METHYL2(((2Z)2((2FLUOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
methyl2(((2Z)2(2fluorobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
METHYL2(2((2FLUOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
MFCD06295934
ZINC000009051885
ZINC000009051889

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.