Vitas-M small molecule compound

2-{(2E)-2-[2-(2,4-dinitrophenyl)hydrazinylidene]propyl}-4,5-dinitro-2H-1,2,3-triazole 1-oxide

Catalog ID
STK676534
SMILES C/C(=N\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/Cn1nc(c([n+]1[O-])[N+](=O)[O-])[N+](=O)[O-]

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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 C11H9N9O9 MW 411.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9N9O9/c1-6(5-15-14-10(19(26)27)11(16(15)21)20(28)29)12-13-8-3-2-7(17(22)23)4-9(8)18(24)25/h2-4,13H,5H2,1H3/b12-6+
InChIKey
VKEVWYPKXMHYLP-WUXMJOGZSA-N
Synonyms

2((2E)2(2(24dinitrophenyl)hydrazinylidene)propyl)45dinitro2H123triazole1oxide
CC(=NNC1=C(C=C(C=C1)(N+)(=O)(O))(N+)(=O)(O))CN2N=C(C(=(N+)2(O))(N+)(=O)(O))(N+)(=O)(O)
CC(=NNc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))Cn1nc(c((n+)1(O))(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC11H9N9O9c16(5151410(19(26)27)11(16(15)21)20(28)29)12138327(17(22)23)49(8)18(24)25h2413H5H21H3b126+
MFCD02646673
N((E)1(45dinitro1oxidotriazol1ium2yl)propan2ylideneamino)24dinitroaniline
ZINC000100091864

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Available files

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