Vitas-M small molecule compound

1,3-dimethyl-4,5,6-trinitro-1,3-dihydro-2H-benzimidazol-2-one

Catalog ID
STK368563
SMILES Cn1c(=O)n(c2c1cc([N+](=O)[O-])c(c2[N+](=O)[O-])[N+](=O)[O-])C

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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 C9H7N5O7 MW 297.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7N5O7/c1-10-4-3-5(12(16)17)7(13(18)19)8(14(20)21)6(4)11(2)9(10)15/h3H,1-2H3
InChIKey
FTRJSVVYDNUFBP-UHFFFAOYSA-N
Synonyms
98590-15-9
13dimethyl456trinitro13dihydro2Hbenzimidazol2one
13DIMETHYL456TRINITRO13DIHYDROBENZOIMIDAZOL2ONE
13DIMETHYL456TRINITRO3HYDROBENZIMIDAZOL2ONE
13DIMETHYL456TRINITROBENZIMIDAZOL2ONE
456TRISNITRO13DIMETHYL13DIHYDRO2HBENZIMIDAZOL2ONE
98590159
Cn1c(=O)n(c2c1cc((N+)(=O)(O))c(c2(N+)(=O)(O))(N+)(=O)(O))C
CN1C2=CC(=C(C(=C2N(C1=O)C)(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC9H7N5O7c110435(12(16)17)7(13(18)19)8(14(20)21)6(4)11(2)9(10)15h3H12H3
MFCD00419776
ZINC000008398181
ZINC08398181
ZINC8398181

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Available files

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