Vitas-M small molecule compound

(2Z)-2-(2,4-dimethoxybenzylidene)-6-[(2-methylbenzyl)oxy]-1-benzofuran-3(2H)-one

Catalog ID
STK923328
SMILES COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2)OCc1ccccc1C

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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 C25H22O5 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22O5/c1-16-6-4-5-7-18(16)15-29-20-10-11-21-23(14-20)30-24(25(21)26)12-17-8-9-19(27-2)13-22(17)28-3/h4-14H,15H2,1-3H3/b24-12-
InChIKey
KNLCRICAEAFGMZ-MSXFZWOLSA-N
Synonyms
858769-86-5
(2Z)2((24DIMETHOXYPHENYL)METHYLIDENE)6((2METHYLPHENYL)METHOXY)1BENZOFURAN3ONE
(2Z)2(24dimethoxybenzylidene)6((2methylbenzyl)oxy)1benzofuran3(2H)one
(Z)2(24dimethoxybenzylidene)6((2methylbenzyl)oxy)benzofuran3(2H)one
2((24DIMETHOXYPHENYL)METHYLENE)6((2METHYLPHENYL)METHOXY)BENZO(B)FURAN3ONE
858769865
CC1=CC=CC=C1COC2=CC3=C(C=C2)C(=O)C(=CC4=C(C=C(C=C4)OC)OC)O3
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2)OCc1ccccc1C
InChI=1SC25H22O5c116645718(16)15292010112123(1420)3024(25(21)26)12178919(272)1322(17)283h414H15H213H3b2412
MFCD04145883
ZINC000012861241
ZINC12861241

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Available files

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