Vitas-M small molecule compound

5,6-dinitro-1,3-dihydro-2H-benzimidazol-2-one

Catalog ID
STL372621
SMILES [O-][N+](=O)c1cc2[nH]c(=O)[nH]c2cc1[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 C7H4N4O5 MW 224.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H4N4O5/c12-7-8-3-1-5(10(13)14)6(11(15)16)2-4(3)9-7/h1-2H,(H2,8,9,12)
InChIKey
TZDUUWCJIOBQOD-UHFFFAOYSA-N
Synonyms
3705-86-0
(O)(N+)(=O)c1cc2(nH)c(=O)(nH)c2cc1(N+)(=O)(O)
13DIHYDRO56DINITRO2HBENZIMIDAZOL2ONE
2HBENZIMIDAZOL2ONE13DIHYDRO56DINITRO
3705860
56DINITRO13DIHYDRO13BENZODIAZOL2ONE
56dinitro13dihydro2Hbenzimidazol2one
56DINITRO13DIHYDROBENZIMIDAZOL2ONE
56DINITRO13DIHYDROBENZOIMIDAZOL2ONE
56DINITRO3HYDROBENZIMIDAZOL2ONE
BENZIMIDAZOLE2ONE56DINITRO
C1=C2C(=CC(=C1(N+)(=O)(O))(N+)(=O)(O))NC(=O)N2
InChI=1SC7H4N4O5c1278315(10(13)14)6(11(15)16)24(3)97h12H(H28912)
MFCD00991149
ZINC000015009346
ZINC15009346

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Available files

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