Pyridine 2-aldoxime
TL;DR: Pyridine 2-aldoxime (CAS 873-69-8) is a chemical compound with molecular formula C6H6N2O and molecular weight 122.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(pyridin-2-ylmethylidene)hydroxylamine
Also Known As: Pyridine-2-aldoxime, Picolinaldehyde oxime, (E)-Picolinaldehyde oxime, pyridyl-nitrone, 2-Pyridinaldoxime
| Molecular Formula | C6H6N2O |
|---|---|
| Molecular Weight | 122.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 122.04801 |
| Heavy Atoms | 9 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 873-69-8 |
|---|---|
| SMILES | C1=CC=NC(=C1)C=NO |
| InChIKey | MTFJSAGADRTKCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridine 2-aldoxime (CAS 873-69-8), with molecular formula C6H6N2O and molecular weight 122.05 g/mol. IUPAC: N-(pyridin-2-ylmethylidene)hydroxylamine.
Chemical Property Profile of Pyridine 2-aldoxime
Property Insights of Pyridine 2-aldoxime
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine 2-aldoxime. With a topological polar surface area (TPSA) of 45.5 Ų, Pyridine 2-aldoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine 2-aldoxime has 1 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 Pyridine 2-aldoxime?
The CAS number of Pyridine 2-aldoxime is 873-69-8.
What is the molecular formula of Pyridine 2-aldoxime?
The molecular formula of Pyridine 2-aldoxime is C6H6N2O.
What is the molecular weight of Pyridine 2-aldoxime?
The molecular weight of Pyridine 2-aldoxime is 122.05 g/mol.
Where can I buy Pyridine 2-aldoxime?
You can request a quote for Pyridine 2-aldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine 2-aldoxime?
Yes, KEHONG BIO provides custom synthesis services for Pyridine 2-aldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.