4,4'-Dinitro-1,1'-biphenyl
TL;DR: 4,4'-Dinitro-1,1'-biphenyl (CAS 1528-74-1) is a chemical compound with molecular formula C12H8N2O4 and molecular weight 244.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-nitro-4-(4-nitrophenyl)benzene
Also Known As: 4,4'-DINITROBIPHENYL, 4,4'-Dinitro-1,1'-biphenyl, 4,4'-Dinitrodiphenyl, 4,4'-Dinitrobifenyl, Biphenyl, 4,4'-dinitro-
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H8N2O4 |
| Molecular Weight | 244.0484 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.0484 Da |
| Heavy Atoms | 18 |
| Complexity | 275.0 |
| Melting Point | 240-243 °C |
| Solubility | INSOL IN WATER; SOL IN HOT ALCOHOL, BENZENE & ACETIC ACID |
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | BDLNCFCZHNKBGI-UHFFFAOYSA-N |
Chemical Property Profile of 4,4'-Dinitro-1,1'-biphenyl
Property Insights of 4,4'-Dinitro-1,1'-biphenyl
The XLogP value of 3.6 indicates that 4,4'-Dinitro-1,1'-biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-Dinitro-1,1'-biphenyl. Following Lipinski's Rule of Five, 4,4'-Dinitro-1,1'-biphenyl has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,4'-Dinitro-1,1'-biphenyl?
The CAS number of 4,4'-Dinitro-1,1'-biphenyl is 1528-74-1.
What is the molecular formula of 4,4'-Dinitro-1,1'-biphenyl?
The molecular formula of 4,4'-Dinitro-1,1'-biphenyl is C12H8N2O4.
What is the molecular weight of 4,4'-Dinitro-1,1'-biphenyl?
The molecular weight of 4,4'-Dinitro-1,1'-biphenyl is 244.0484 g/mol.
Where can I buy 4,4'-Dinitro-1,1'-biphenyl?
You can request a quote for 4,4'-Dinitro-1,1'-biphenyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4'-Dinitro-1,1'-biphenyl?
Yes, CoreyChem provides custom synthesis services for 4,4'-Dinitro-1,1'-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.