Vitas-M small molecule compound
2,2-dimethyl-7,7-dinitro-2,5,6,7-tetrahydro-4H-benzimidazol-4-one 1,3-dioxide
Catalog ID
STK528848
SMILES O=C1CCC(C2=[N+](C([N+](=C12)[O-])(C)C)[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 C9H10N4O7 MW 286.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10N4O7/c1-8(2)10(15)6-5(14)3-4-9(12(17)18,13(19)20)7(6)11(8)16/h3-4H2,1-2H3InChIKey
QWHJJTNVPGNUMF-UHFFFAOYSA-NSynonyms
304877-19-822dimethyl44dinitro7oxo4567tetrahydro2Hbenzo(d)imidazole13dioxide
22DIMETHYL77DINITRO1OXIDO3OXO56DIHYDROBENZIMIDAZOL3IUM4ONE
22dimethyl77dinitro2567tetrahydro4Hbenzimidazol4one13dioxide
304877198
CC1(N(C2=C((N+)1=O)C(=O)CCC2((N+)(=O)(O))(N+)(=O)(O))(O))C
InChI=1SC9H10N4O7c18(2)10(15)65(14)349(12(17)1813(19)20)7(6)11(8)16h34H212H3
MFCD00168410
O=C1CCC(C2=(N+)(C((N+)(=C12)(O))(C)C)(O))((N+)(=O)(O))(N+)(=O)(O)
ZINC000334156969
ZINC19330149
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