Vitas-M small molecule compound

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

Catalog ID
STK923388
SMILES COC(=O)C(Oc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/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 C19H14ClFO5 MW 376.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClFO5/c1-10(19(23)24-2)25-11-6-7-12-16(8-11)26-17(18(12)22)9-13-14(20)4-3-5-15(13)21/h3-10H,1-2H3/b17-9-
InChIKey
BVDMMNZZRNKSPI-MFOYZWKCSA-N
Synonyms
845800-41-1
(Z)methyl2((2(2chloro6fluorobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)propanoate
845800411
CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CC3=C(C=CC=C3Cl)F)O2
COC(=O)C(Oc1ccc2c(c1)OC(=Cc1c(F)cccc1Cl)C2=O)C
InChI=1SC19H14ClFO5c110(19(23)242)2511671216(811)2617(18(12)22)91314(20)43515(13)21h310H12H3b179
METHYL2(((2Z)2((2CHLORO6FLUOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)PROPANOATE
methyl2(((2Z)2(2chloro6fluorobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)propanoate
METHYL2(2((2CHLORO6FLUOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)PROPANOATE
MFCD04170454
ZINC000005185418
ZINC000005185420

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Available files

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