(1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-
TL;DR: (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- (CAS 60262-92-2) is a chemical compound with molecular formula C14H7N3O10 and molecular weight 377.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-carboxy-4-nitrophenyl)-3,5-dinitrobenzoic acid
Also Known As: 4,4',6-Trinitrodiphenic acid, Diphenic acid, 4,4',6-trinitro-, 2,4,4'-Trinitrobiphenyl-2',6-dicarboxylic acid, (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-, Diphenic acid, 4,4',6-trinitro- (6CI)
| Molecular Formula | C14H7N3O10 |
|---|---|
| Molecular Weight | 377.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 212.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.01315 |
| Heavy Atoms | 27 |
| Complexity | 651.0 |
Chemical Identifiers
| CAS Number | 60262-92-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C(=O)O |
| InChIKey | JXVQYKBIKMQQHD-UHFFFAOYSA-N |
Product Overview
(1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- (CAS 60262-92-2), with molecular formula C14H7N3O10 and molecular weight 377.01 g/mol. IUPAC: 2-(2-carboxy-4-nitrophenyl)-3,5-dinitrobenzoic acid.
Chemical Property Profile of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-
Property Insights of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-. The TPSA of 212.0 Ų indicates high polarity, suggesting (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- 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 (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-?
The CAS number of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- is 60262-92-2.
What is the molecular formula of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-?
The molecular formula of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- is C14H7N3O10.
What is the molecular weight of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-?
The molecular weight of (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- is 377.01 g/mol.
Where can I buy (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro-?
You can request a quote for (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- 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'-dicarboxylic acid, 4,4',6-trinitro-?
Yes, KEHONG BIO provides custom synthesis services for (1,1'-Biphenyl)-2,2'-dicarboxylic acid, 4,4',6-trinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.