Vitas-M small molecule compound

methyl 2-{[4-(1-benzofuran-2-yl)-2-oxo-2H-chromen-6-yl]oxy}propanoate

Catalog ID
STL034217
SMILES COC(=O)C(Oc1ccc2c(c1)c(cc(=O)o2)c1cc2c(o1)cccc2)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 C21H16O6 MW 364.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16O6/c1-12(21(23)24-2)25-14-7-8-18-15(10-14)16(11-20(22)27-18)19-9-13-5-3-4-6-17(13)26-19/h3-12H,1-2H3
InChIKey
MCIIEFAEEXKORM-UHFFFAOYSA-N
Synonyms
898430-03-0
898430030
CC(C(=O)OC)OC1=CC2=C(C=C1)OC(=O)C=C2C3=CC4=CC=CC=C4O3
InChI=1SC21H16O6c112(21(23)242)2514781815(1014)16(1120(22)2718)19913534617(13)2619h312H12H3
methyl2((4(1benzofuran2yl)2oxo2Hchromen6yl)oxy)propanoate
METHYL2((4(BENZOFURAN2YL)2OXO2HCHROMEN6YL)OXY)PROPANOATE
methyl2(4(1benzofuran2yl)2oxochromen6yl)oxypropanoate
METHYL2(4BENZO(D)FURAN2YL2OXOCHROMEN6YLOXY)PROPANOATE
MFCD07648861
ZINC000004586196
ZINC000004586197

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Available files

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