4,4'-Dihydroxy-3,3'-dinitrobiphenyl
TL;DR: 4,4'-Dihydroxy-3,3'-dinitrobiphenyl (CAS 66041-61-0) is a chemical compound with molecular formula C12H8N2O6 and molecular weight 276.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxy-3-nitrophenyl)-2-nitrophenol
Also Known As: 4,4'-Dihydroxy-3,3'-dinitrobiphenyl, 3,3'-dinitro-4,4'-dihydroxybiphenyl, 4-(4-hydroxy-3-nitrophenyl)-2-nitrophenol, 3,3'-dinitro-[1,1'-biphenyl]-4,4'-diol, 3,3 -Dinitrobiphenyl-4,4 -diol
| Molecular Formula | C12H8N2O6 |
|---|---|
| Molecular Weight | 276.04 g/mol |
| LogP | 2.5812 |
| Topological Polar Surface Area | 126.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.03824 |
| Heavy Atoms | 20 |
| Complexity | 651.58887 |
Chemical Identifiers
| CAS Number | 66041-61-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=CC(=C(C=C2)O)[N+](=O)[O-])[N+](=O)[O-])O |
Product Overview
4,4'-Dihydroxy-3,3'-dinitrobiphenyl (CAS 66041-61-0), with molecular formula C12H8N2O6 and molecular weight 276.04 g/mol. IUPAC: 4-(4-hydroxy-3-nitrophenyl)-2-nitrophenol.
Chemical Property Profile of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl
Property Insights of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl
The XLogP value of 2.5812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-Dihydroxy-3,3'-dinitrobiphenyl. The TPSA of 126.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-Dihydroxy-3,3'-dinitrobiphenyl. Following Lipinski's Rule of Five, 4,4'-Dihydroxy-3,3'-dinitrobiphenyl has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl?
The CAS number of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl is 66041-61-0.
What is the molecular formula of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl?
The molecular formula of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl is C12H8N2O6.
What is the molecular weight of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl?
The molecular weight of 4,4'-Dihydroxy-3,3'-dinitrobiphenyl is 276.04 g/mol.
Where can I buy 4,4'-Dihydroxy-3,3'-dinitrobiphenyl?
You can request a quote for 4,4'-Dihydroxy-3,3'-dinitrobiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dihydroxy-3,3'-dinitrobiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dihydroxy-3,3'-dinitrobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.