2-(3,4-Dinitrobenzyl)pyridine
TL;DR: 2-(3,4-Dinitrobenzyl)pyridine (CAS 136133-84-1) is a chemical compound with molecular formula C12H9N3O4 and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dinitrophenyl)methyl]pyridine
Also Known As: 2-(3,4-dinitrobenzyl)pyridine, 2-[(3,4-dinitrophenyl)methyl]pyridine, 657-161-0, RefChem:454667
| Molecular Formula | C12H9N3O4 |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | 2.4888 |
| Topological Polar Surface Area | 99.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.0593 |
| Heavy Atoms | 19 |
| Complexity | 628.1265 |
Chemical Identifiers
| CAS Number | 136133-84-1 |
|---|---|
| SMILES | C1=CC=NC(=C1)CC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-(3,4-Dinitrobenzyl)pyridine (CAS 136133-84-1), with molecular formula C12H9N3O4 and molecular weight 259.06 g/mol. IUPAC: 2-[(3,4-dinitrophenyl)methyl]pyridine.
Chemical Property Profile of 2-(3,4-Dinitrobenzyl)pyridine
Property Insights of 2-(3,4-Dinitrobenzyl)pyridine
The XLogP value of 2.4888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dinitrobenzyl)pyridine. The TPSA of 99.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dinitrobenzyl)pyridine. Following Lipinski's Rule of Five, 2-(3,4-Dinitrobenzyl)pyridine has 0 hydrogen bond donor(s) and 5 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-(3,4-Dinitrobenzyl)pyridine?
The CAS number of 2-(3,4-Dinitrobenzyl)pyridine is 136133-84-1.
What is the molecular formula of 2-(3,4-Dinitrobenzyl)pyridine?
The molecular formula of 2-(3,4-Dinitrobenzyl)pyridine is C12H9N3O4.
What is the molecular weight of 2-(3,4-Dinitrobenzyl)pyridine?
The molecular weight of 2-(3,4-Dinitrobenzyl)pyridine is 259.06 g/mol.
Where can I buy 2-(3,4-Dinitrobenzyl)pyridine?
You can request a quote for 2-(3,4-Dinitrobenzyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dinitrobenzyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dinitrobenzyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.