Vitas-M small molecule compound

methyl 2-(7,8-dimethoxy-2-oxo-2H-chromen-4-yl)-3-(4-fluorophenyl)propanoate

Catalog ID
STL239398
SMILES COC(=O)C(c1cc(=O)oc2c1ccc(c2OC)OC)Cc1ccc(cc1)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 C21H19FO6 MW 386.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FO6/c1-25-17-9-8-14-15(11-18(23)28-19(14)20(17)26-2)16(21(24)27-3)10-12-4-6-13(22)7-5-12/h4-9,11,16H,10H2,1-3H3
InChIKey
HRESOJZEBFGRFP-UHFFFAOYSA-N
Synonyms
951989-39-2
951989392
COC1=C(C2=C(C=C1)C(=CC(=O)O2)C(CC3=CC=C(C=C3)F)C(=O)OC)OC
InChI=1SC21H19FO6c12517981415(1118(23)2819(14)20(17)262)16(21(24)273)10124613(22)7512h491116H10H213H3
methyl2(78dimethoxy2oxo2Hchromen4yl)3(4fluorophenyl)propanoate
methyl2(78dimethoxy2oxochromen4yl)3(4fluorophenyl)propanoate
MFCD09858203
ZINC000013733202
ZINC000013733204

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Available files

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