1,1'-Biphenyl, 2,2',6,6'-tetranitro-
TL;DR: 1,1'-Biphenyl, 2,2',6,6'-tetranitro- (CAS 2528-00-9) is a chemical compound with molecular formula C12H6N4O8 and molecular weight 334.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,6-dinitrophenyl)-1,3-dinitrobenzene
Also Known As: 2,2',6,6'-Tetranitro-1,1'-biphenyl, 2,2',6,6'-tetranitrobiphenyl, 1,1'-Biphenyl, 2,2',6,6'-tetranitro-, 2,2',6,6'-tetra-nitrobiphenyl, 2-(2,6-dinitrophenyl)-1,3-dinitrobenzene
| Molecular Formula | C12H6N4O8 |
|---|---|
| Molecular Weight | 334.02 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.01855 |
| Heavy Atoms | 24 |
| Complexity | 441.0 |
Chemical Identifiers
| CAS Number | 2528-00-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])C2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FBVPTHLEHALHAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1'-Biphenyl, 2,2',6,6'-tetranitro- (CAS 2528-00-9), with molecular formula C12H6N4O8 and molecular weight 334.02 g/mol. IUPAC: 2-(2,6-dinitrophenyl)-1,3-dinitrobenzene.
Chemical Property Profile of 1,1'-Biphenyl, 2,2',6,6'-tetranitro-
Property Insights of 1,1'-Biphenyl, 2,2',6,6'-tetranitro-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-Biphenyl, 2,2',6,6'-tetranitro-. The TPSA of 183.0 Ų indicates high polarity, suggesting 1,1'-Biphenyl, 2,2',6,6'-tetranitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,1'-Biphenyl, 2,2',6,6'-tetranitro- has 0 hydrogen bond donor(s) and 8 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 1,1'-Biphenyl, 2,2',6,6'-tetranitro-?
The CAS number of 1,1'-Biphenyl, 2,2',6,6'-tetranitro- is 2528-00-9.
What is the molecular formula of 1,1'-Biphenyl, 2,2',6,6'-tetranitro-?
The molecular formula of 1,1'-Biphenyl, 2,2',6,6'-tetranitro- is C12H6N4O8.
What is the molecular weight of 1,1'-Biphenyl, 2,2',6,6'-tetranitro-?
The molecular weight of 1,1'-Biphenyl, 2,2',6,6'-tetranitro- is 334.02 g/mol.
Where can I buy 1,1'-Biphenyl, 2,2',6,6'-tetranitro-?
You can request a quote for 1,1'-Biphenyl, 2,2',6,6'-tetranitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Biphenyl, 2,2',6,6'-tetranitro-?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Biphenyl, 2,2',6,6'-tetranitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.