Vitas-M small molecule compound

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

Catalog ID
STK924281
SMILES COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C1CC1

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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/c1-24-16-5-3-4-13(20(16)25-2)10-18-19(22)15-9-8-14(11-17(15)27-18)26-21(23)12-6-7-12/h3-5,8-12H,6-7H2,1-2H3/b18-10-
InChIKey
MUNVZBQLCYYCQN-ZDLGFXPLSA-N
Synonyms
622799-91-1
((2Z)2((23DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)CYCLOPROPANECARBOXYLATE
(2Z)2(23dimethoxybenzylidene)3oxo23dihydro1benzofuran6ylcyclopropanecarboxylate
(Z)2(23dimethoxybenzylidene)3oxo23dihydrobenzofuran6ylcyclopropanecarboxylate
2((23DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLCYCLOPROPANECARBOXYLATE
622799911
COC1=CC=CC(=C1OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4CC4
COc1c(cccc1OC)C=C1Oc2c(C1=O)ccc(c2)OC(=O)C1CC1
InChI=1SC21H18O6c1241653413(20(16)252)101819(22)159814(1117(15)2718)2621(23)126712h35812H67H212H3b1810
MFCD04186251
ZINC000013777899
ZINC13777899

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Available files

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