2-(Nitromethyl)pyridine
TL;DR: 2-(Nitromethyl)pyridine (CAS 3243-07-0) is a chemical compound with molecular formula C6H6N2O2 and molecular weight 138.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(nitromethyl)pyridine
Also Known As: 2-(nitromethyl)pyridine, 2-Nitromethyl-pyridin, 2-nitromethyl-pyridine, RefChem:254448
| Molecular Formula | C6H6N2O2 |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.04292 |
| Heavy Atoms | 10 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 3243-07-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)C[N+](=O)[O-] |
| InChIKey | KBRRIEFTVXTTCR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Nitromethyl)pyridine (CAS 3243-07-0), with molecular formula C6H6N2O2 and molecular weight 138.04 g/mol. IUPAC: 2-(nitromethyl)pyridine.
Chemical Property Profile of 2-(Nitromethyl)pyridine
Property Insights of 2-(Nitromethyl)pyridine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Nitromethyl)pyridine. With a topological polar surface area (TPSA) of 58.7 Ų, 2-(Nitromethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Nitromethyl)pyridine has 0 hydrogen bond donor(s) and 3 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-(Nitromethyl)pyridine?
The CAS number of 2-(Nitromethyl)pyridine is 3243-07-0.
What is the molecular formula of 2-(Nitromethyl)pyridine?
The molecular formula of 2-(Nitromethyl)pyridine is C6H6N2O2.
What is the molecular weight of 2-(Nitromethyl)pyridine?
The molecular weight of 2-(Nitromethyl)pyridine is 138.04 g/mol.
Where can I buy 2-(Nitromethyl)pyridine?
You can request a quote for 2-(Nitromethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Nitromethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Nitromethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.