Vitas-M small molecule compound

ethyl 2-tert-butyl-5-{[(3,4,5-trimethoxyphenyl)carbonyl]oxy}-1-benzofuran-3-carboxylate

Catalog ID
STK845627
SMILES CCOC(=O)c1c2cc(ccc2oc1C(C)(C)C)OC(=O)c1cc(OC)c(c(c1)OC)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 C25H28O8 MW 456.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28O8/c1-8-31-24(27)20-16-13-15(9-10-17(16)33-22(20)25(2,3)4)32-23(26)14-11-18(28-5)21(30-7)19(12-14)29-6/h9-13H,8H2,1-7H3
InChIKey
LKQHEODPHALZRQ-UHFFFAOYSA-N
Synonyms
578736-93-3
2(TERTBUTYL)3(ETHOXYCARBONYL)BENZO(B)FURAN5YL345TRIMETHOXYBENZOATE
3BENZO(B)FURANCARBOXYLICACID2(11DIMETHYLETHYL)5((345TRIMETHOXYBENZOYL)OXY)ETHYLESTER
3BENZOFURANCARBOXYLICACID2(11DIMETHYLETHYL)5((345TRIMETHOXYBENZOYL)OXY)ETHYLESTER(9CI)
3BENZOFURANCARBOXYLICACID2(TERTBUTYL)5((345TRIMETHOXYBENZOYL)OXY)ETHYLESTER
3BENZOFURANCARBOXYLICACID25(OXY)ETHYLESTER
578736933
CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(C)(C)C
ETHYL2(TERTBUTYL)5((345TRIMETHOXYBENZOYL)OXY)BENZOFURAN3CARBOXYLATE
ethyl2tertbutyl5(((345trimethoxyphenyl)carbonyl)oxy)1benzofuran3carboxylate
ETHYL2TERTBUTYL5(345TRIMETHOXYBENZOYL)OXY1BENZOFURAN3CARBOXYLATE
InChI=1SC25H28O8c183124(27)20161315(91017(16)3322(20)25(23)4)3223(26)141118(285)21(307)19(1214)296h913H8H217H3
MFCD04031885
ZINC000002394878
ZINC02394878
ZINC2394878

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Available files

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