Vitas-M small molecule compound

methyl (2Z)-2-(2-fluorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate

Catalog ID
STK819236
SMILES COC(=O)c1ccc2c(c1)C(=O)/C(=C/c1ccccc1F)/O2

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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 C17H11FO4 MW 298.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11FO4/c1-21-17(20)11-6-7-14-12(8-11)16(19)15(22-14)9-10-4-2-3-5-13(10)18/h2-9H,1H3/b15-9-
InChIKey
AAUFFZAFEPWCBF-DHDCSXOGSA-N
Synonyms
868144-01-8
868144018
COC(=O)C1=CC2=C(C=C1)OC(=CC3=CC=CC=C3F)C2=O
COC(=O)c1ccc2c(c1)C(=O)C(=Cc1ccccc1F)O2
InChI=1SC17H11FO4c12117(20)11671412(811)16(19)15(2214)910423513(10)18h29H1H3b159
METHYL(2Z)2((2FLUOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN5CARBOXYLATE
methyl(2Z)2(2fluorobenzylidene)3oxo23dihydro1benzofuran5carboxylate
METHYL2((2FLUOROPHENYL)METHYLENE)3OXOBENZO(B)FURAN5CARBOXYLATE
MFCD04448310
ZINC000000429852
ZINC00429852
ZINC429852

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Available files

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