Vitas-M small molecule compound

(2Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl cyclopropanecarboxylate

Catalog ID
STK923606
SMILES COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C1CC1)OC

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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 C21H18O6 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18O6/c1-24-14-6-8-17(25-2)13(9-14)10-19-20(22)16-7-5-15(11-18(16)27-19)26-21(23)12-3-4-12/h5-12H,3-4H2,1-2H3/b19-10-
InChIKey
ODRINHLXFDUGIN-GRSHGNNSSA-N
Synonyms
858762-56-8
((2Z)2((25DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)CYCLOPROPANECARBOXYLATE
(2Z)2(25dimethoxybenzylidene)3oxo23dihydro1benzofuran6ylcyclopropanecarboxylate
(Z)2(25dimethoxybenzylidene)3oxo23dihydrobenzofuran6ylcyclopropanecarboxylate
2((25DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLCYCLOPROPANECARBOXYLATE
858762568
COC1=CC(=C(C=C1)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4CC4
COc1ccc(cc1C=C1Oc2c(C1=O)ccc(c2)OC(=O)C1CC1)OC
InChI=1SC21H18O6c124146817(252)13(914)101920(22)167515(1118(16)2719)2621(23)123412h512H34H212H3b1910
MFCD04142951
ZINC000012662616
ZINC12662616

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Available files

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