Benzimidazole, 1-((p-nitrophenoxy)methyl)-, picrate
1-[(4-nitrophenoxy)methyl]benzimidazole;2,4,6-trinitrophenol
Also Known As: 1-Nitro-2,2-dimethylpropane|1-((p-Nitrophenoxy)methyl)-benzimidazole picrate|Benzimidazole, 1-((p-nitrophenoxy)methyl)-, picrate|2,4,6-trinitrophenol- 1-[(4-nitrophenoxy)methyl]-1h-benzimidazole(1:1)|1-[(4-nitrophenoxy)methyl]benzimidazole,2,4,6-trinitrophenol|1-[(4-nitrophenoxy)methyl]benzimidazole; 2,4,6-trinitrophenol|2,4,6-Trinitrophenol--1-[(4-nitrophenoxy)methyl]-1H-1,3-benzimidazole (1/1)
| Molecular Formula | C20H14N6O10 |
|---|---|
| Molecular Weight | 498.07715 g/mol |
| LogP | 4.0978 |
| Topological Polar Surface Area | 231.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 3 |
| Exact Mass | 498.07715 |
| Monoisotopic Mass | 498.07715 |
| Heavy Atoms | 36 |
| Complexity | 631.0 |
Chemical Identifiers
| CAS Number | 393-79-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CN2COC3=CC=C(C=C3)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | JSGVRLSKJZWSLO-UHFFFAOYSA-N |
Product Overview
Benzimidazole, 1-((p-nitrophenoxy)methyl)-, picrate (CAS 393-79-3), with molecular formula C20H14N6O10 and molecular weight 498.07715 g/mol. IUPAC: 1-[(4-nitrophenoxy)methyl]benzimidazole;2,4,6-trinitrophenol.
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