3,5,3',5'-Tetranitro-biphenyl-4,4'-diol
TL;DR: 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol (CAS 48213-06-5) is a chemical compound with molecular formula C12H6N4O10 and molecular weight 366.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxy-3,5-dinitrophenyl)-2,6-dinitrophenol
Also Known As: 4,4 -Bi[2,6-dinitrophenol], 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol, 3,5,3'',5''-Tetranitro-biphenyl-4,4''-diol, 3,3 ,5,5 -Tetranitro-4,4 -biphenyldiol, 3,3 ,5,5 -Tetranitrobiphenyl-4,4 -diol
| Molecular Formula | C12H6N4O10 |
|---|---|
| Molecular Weight | 366.01 g/mol |
| LogP | 2.3976 |
| Topological Polar Surface Area | 213.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.0084 |
| Heavy Atoms | 26 |
| Complexity | 836.4616 |
Chemical Identifiers
| CAS Number | 48213-06-5 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C2=CC(=C(C(=C2)[N+](=O)[O-])O)[N+](=O)[O-] |
Product Overview
3,5,3',5'-Tetranitro-biphenyl-4,4'-diol (CAS 48213-06-5), with molecular formula C12H6N4O10 and molecular weight 366.01 g/mol. IUPAC: 4-(4-hydroxy-3,5-dinitrophenyl)-2,6-dinitrophenol.
Chemical Property Profile of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol
Property Insights of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol
The XLogP value of 2.3976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol. The TPSA of 213.02 Ų indicates high polarity, suggesting 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol has 2 hydrogen bond donor(s) and 10 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 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol?
The CAS number of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol is 48213-06-5.
What is the molecular formula of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol?
The molecular formula of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol is C12H6N4O10.
What is the molecular weight of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol?
The molecular weight of 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol is 366.01 g/mol.
Where can I buy 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol?
You can request a quote for 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol?
Yes, KEHONG BIO provides custom synthesis services for 3,5,3',5'-Tetranitro-biphenyl-4,4'-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.