Vitas-M small molecule compound
2,2'-[(2,3,5,6-tetrafluorobenzene-1,4-diyl)bis(oxybenzene-2,1-diyl)]bis(3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione)
Catalog ID
STK674583
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1Oc1c(F)c(F)c(c(c1F)F)Oc1ccccc1N1C(=O)C2C(C1=O)C1CC2C=C1)C3
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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 C36H24F4N2O6 MW 656.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H24F4N2O6/c37-27-29(39)32(48-22-8-4-2-6-20(22)42-35(45)25-17-11-12-18(14-17)26(25)36(42)46)30(40)28(38)31(27)47-21-7-3-1-5-19(21)41-33(43)23-15-9-10-16(13-15)24(23)34(41)44/h1-12,15-18,23-26H,13-14H2InChIKey
DKJYQTWWLDUIOL-UHFFFAOYSA-NSynonyms
22((2356tetrafluorobenzene14diyl)bis(oxybenzene21diyl))bis(3a477atetrahydro1H47methanoisoindole13(2H)dione)
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4OC5=C(C(=C(C(=C5F)F)OC6=CC=CC=C6N7C(=O)C8C9CC(C8C7=O)C=C9)F)F
InChI=1SC36H24F4N2O6c372729(39)32(4822842620(22)4235(45)2517111218(1417)26(25)36(42)46)30(40)28(38)31(27)4721731519(21)4133(43)231591016(1315)24(23)34(41)44h11215182326H1314H2
MFCD00779323
ZINC000150360979
ZINC000239296811
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