Vitas-M small molecule compound

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

Catalog ID
STK924013
SMILES CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/C2=O

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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 C25H18ClFO5 MW 452.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFO5/c1-2-30-25(29)24(15-7-4-3-5-8-15)31-16-11-12-17-21(13-16)32-22(23(17)28)14-18-19(26)9-6-10-20(18)27/h3-14,24H,2H2,1H3/b22-14-
InChIKey
AMBGQTASRFMHAR-HMAPJEAMSA-N
Synonyms
877790-37-9
(Z)ethyl2((2(2chloro6fluorobenzylidene)3oxo23dihydrobenzofuran6yl)oxy)2phenylacetate
877790379
CCOC(=O)C(C1=CC=CC=C1)OC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=CC=C4Cl)F)O3
CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)OC(=Cc1c(F)cccc1Cl)C2=O
ethyl(((2Z)2(2chloro6fluorobenzylidene)3oxo23dihydro1benzofuran6yl)oxy)(phenyl)acetate
ETHYL2(((2Z)2((2CHLORO6FLUOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)OXY)2PHENYLACETATE
ETHYL2(2((2CHLORO6FLUOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLOXY)2PHENYLACETATE
InChI=1SC25H18ClFO5c123025(29)24(157435815)311611121721(1316)3222(23(17)28)141819(26)961020(18)27h31424H2H21H3b2214
MFCD05702072
ZINC000009345346
ZINC000011869272

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Available files

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