(1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-
TL;DR: (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- (CAS 41725-30-8) is a chemical compound with molecular formula C14H8N2O8 and molecular weight 332.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-carboxy-2-nitrophenyl)-3-nitrobenzoic acid
Also Known As: 4-(4-carboxy-2-nitrophenyl)-3-nitrobenzoic acid, 2,2'-dinitro-[1,1'-biphenyl]-4,4'-dicarboxylic acid, (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-, 2,2'-dinitro-4,4'-biphenyldicarboxylic acid, 6,6'-dinitro-4,4'-biphenyldicarboxylic acid
| Molecular Formula | C14H8N2O8 |
|---|---|
| Molecular Weight | 332.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.02808 |
| Heavy Atoms | 24 |
| Complexity | 492.0 |
Chemical Identifiers
| CAS Number | 41725-30-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-] |
| InChIKey | HRGSKQRXBGCEAZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- (CAS 41725-30-8), with molecular formula C14H8N2O8 and molecular weight 332.03 g/mol. IUPAC: 4-(4-carboxy-2-nitrophenyl)-3-nitrobenzoic acid.
Chemical Property Profile of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-
Property Insights of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-. The TPSA of 166.0 Ų indicates high polarity, suggesting (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- has 2 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)-4,4'-dicarboxylic acid, 2,2'-dinitro-?
The CAS number of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- is 41725-30-8.
What is the molecular formula of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-?
The molecular formula of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- is C14H8N2O8.
What is the molecular weight of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-?
The molecular weight of (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- is 332.03 g/mol.
Where can I buy (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro-?
You can request a quote for (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- 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)-4,4'-dicarboxylic acid, 2,2'-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for (1,1'-Biphenyl)-4,4'-dicarboxylic acid, 2,2'-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.