Vitas-M small molecule compound
1,3-diethyl-5,6-dinitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL376764
SMILES CCn1c2cc([N+](=O)[O-])c(cc2n(c1=O)CC)[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 C11H12N4O5 MW 280.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4O5/c1-3-12-7-5-9(14(17)18)10(15(19)20)6-8(7)13(4-2)11(12)16/h5-6H,3-4H2,1-2H3InChIKey
AGKSLDXJPABPHL-UHFFFAOYSA-NSynonyms
13diethyl56dinitro13dihydro2Hbenzimidazol2one
13DIETHYL56DINITRO3HYDROBENZIMIDAZOL2ONE
13DIETHYL56DINITROBENZIMIDAZOL2ONE
CCN1C2=CC(=C(C=C2N(C1=O)CC)(N+)(=O)(O))(N+)(=O)(O)
CCn1c2cc((N+)(=O)(O))c(cc2n(c1=O)CC)(N+)(=O)(O)
InChI=1SC11H12N4O5c1312759(14(17)18)10(15(19)20)68(7)13(42)11(12)16h56H34H212H3
MFCD00428992
ZINC000005318789
ZINC05318789
ZINC5318789
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