2,2'-Dinitrobenzidine
TL;DR: 2,2'-Dinitrobenzidine (CAS 5855-71-0) is a chemical compound with molecular formula C12H10N4O4 and molecular weight 274.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-amino-2-nitrophenyl)-3-nitroaniline
Also Known As: 2,2'-Dinitrobenzidine, 2,2-Dinitrobenzidine, Benzidine, 2,2'-dinitro-, 4-(4-amino-2-nitrophenyl)-3-nitroaniline, 2,2'-Dinitro-4,4'-biphenyldiamine
| Molecular Formula | C12H10N4O4 |
|---|---|
| Molecular Weight | 274.07 g/mol |
| LogP | 2.3344 |
| Topological Polar Surface Area | 138.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0702 |
| Heavy Atoms | 20 |
| Complexity | 653.0987 |
Chemical Identifiers
| CAS Number | 5855-71-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1N)[N+](=O)[O-])C2=C(C=C(C=C2)N)[N+](=O)[O-] |
Product Overview
2,2'-Dinitrobenzidine (CAS 5855-71-0), with molecular formula C12H10N4O4 and molecular weight 274.07 g/mol. IUPAC: 4-(4-amino-2-nitrophenyl)-3-nitroaniline.
Chemical Property Profile of 2,2'-Dinitrobenzidine
Property Insights of 2,2'-Dinitrobenzidine
The XLogP value of 2.3344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-Dinitrobenzidine. The TPSA of 138.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-Dinitrobenzidine. Following Lipinski's Rule of Five, 2,2'-Dinitrobenzidine 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 2,2'-Dinitrobenzidine?
The CAS number of 2,2'-Dinitrobenzidine is 5855-71-0.
What is the molecular formula of 2,2'-Dinitrobenzidine?
The molecular formula of 2,2'-Dinitrobenzidine is C12H10N4O4.
What is the molecular weight of 2,2'-Dinitrobenzidine?
The molecular weight of 2,2'-Dinitrobenzidine is 274.07 g/mol.
Where can I buy 2,2'-Dinitrobenzidine?
You can request a quote for 2,2'-Dinitrobenzidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Dinitrobenzidine?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Dinitrobenzidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.