Vitas-M small molecule compound

dimethyl 3-[(4-methylbenzyl)oxy]-2,3'-bi-1-benzofuran-5,5'-dicarboxylate

Catalog ID
STK924912
SMILES COC(=O)c1ccc2c(c1)c(OCc1ccc(cc1)C)c(o2)c1coc2c1cc(cc2)C(=O)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 C28H22O7 MW 470.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22O7/c1-16-4-6-17(7-5-16)14-34-25-21-13-19(28(30)32-3)9-11-24(21)35-26(25)22-15-33-23-10-8-18(12-20(22)23)27(29)31-2/h4-13,15H,14H2,1-3H3
InChIKey
KGNPALXPPIZPGY-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)COC2=C(OC3=C2C=C(C=C3)C(=O)OC)C4=COC5=C4C=C(C=C5)C(=O)OC
dimethyl3((4methylbenzyl)oxy)23bi1benzofuran55dicarboxylate
InChI=1SC28H22O7c1164617(7516)143425211319(28(30)323)91124(21)3526(25)2215332310818(1220(22)23)27(29)312h41315H14H213H3
methyl2(5methoxycarbonyl1benzofuran3yl)3((4methylphenyl)methoxy)1benzofuran5carboxylate
MFCD06644447
ZINC000011865057
ZINC11865057

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Available files

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