Vitas-M small molecule compound
1,1'-bis[4-(methoxycarbonyl)phenyl]-4,4'-bipyridinium dibromide
Catalog ID
STK047587
SMILES COC(=O)c1ccc(cc1)[n+]1ccc(cc1)c1cc[n+](cc1)c1ccc(cc1)C(=O)OC.[Br-].[Br-]
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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 C26H22Br2N2O4 MW 586.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O4.2BrH/c1-31-25(29)21-3-7-23(8-4-21)27-15-11-19(12-16-27)20-13-17-28(18-14-20)24-9-5-22(6-10-24)26(30)32-2;;/h3-18H,1-2H3;2*1H/q+2;;/p-2InChIKey
FWTCWNPKFIGKPO-UHFFFAOYSA-LSynonyms
11BIS(4(METHOXYCARBONYL)PHENYL)44BIPYRIDINIUMDIBROMIDE
COC(=O)C1=CC=C(C=C1)(N+)2=CC=C(C=C2)C3=CC=(N+)(C=C3)C4=CC=C(C=C4)C(=O)OC(Br)(Br)
COC(=O)c1ccc(cc1)(n+)1ccc(cc1)c1cc(n+)(cc1)c1ccc(cc1)C(=O)OC(Br)(Br)
InChI=1SC26H22N2O42BrHc13125(29)213723(8421)27151119(121627)20131728(181420)249522(61024)26(30)322h318H12H32*1Hq+2p2
methyl4(4(1(4methoxycarbonylphenyl)pyridin1ium4yl)pyridin1ium1yl)benzoatedibromide
MFCD01419322
STK047587
ZINC000009434431
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