3,5-Dinitro-1,1'-biphenyl
1,3-dinitro-5-phenylbenzene
Also Known As: 3,5-Dinitro-1,1'-biphenyl|3,5-dinitrobiphenyl|1,3-dinitro-5-phenylbenzene|1,1-Biphenyl, 3,5-dinitro-|1,1'-Biphenyl, 3,5-dinitro-|1,3-dinitro-5-phenyl-benzene|2,2-bipyridine-6,6-dicarboxylic acid|N/A
CAS: 4479-74-7
| Molecular Formula | C12H8N2O4 |
|---|---|
| Molecular Weight | 244.0484 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.0484 |
| Monoisotopic Mass | 244.0484 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 4479-74-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CMZJLRGGVLHBMW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (1 patents)
Organic Building Blocks (6 patents)
Pharmaceutical Intermediates (4 patents)
Product Overview
3,5-Dinitro-1,1'-biphenyl (CAS 4479-74-7), with molecular formula C12H8N2O4 and molecular weight 244.0484 g/mol. IUPAC: 1,3-dinitro-5-phenylbenzene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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