3-吡啶甲醛肟
TL;DR: 3-吡啶甲醛肟 (CAS 1193-92-6) 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.
3-吡啶甲醛肟
N-(pyridin-3-ylmethylidene)hydroxylamine
Also Known As: Nicotinaldehyde oxime, Nicotinaldoxime, 3-pyridine aldoxime, 3-Pyridinealdoxime, Pyridine-3-aldoxime
| Molecular Formula | C6H6N2O |
|---|---|
| Molecular Weight | 122.05 g/mol |
| LogP | 0.6 |
| 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 | 1193-92-6 |
|---|---|
| SMILES | C1=CC(=CN=C1)C=NO |
| InChIKey | YBKOPFQCLSPTPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-吡啶甲醛肟 (CAS 1193-92-6), with molecular formula C6H6N2O and molecular weight 122.05 g/mol. IUPAC: N-(pyridin-3-ylmethylidene)hydroxylamine.
Chemical Property Profile of 3-吡啶甲醛肟
Property Insights of 3-吡啶甲醛肟
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-吡啶甲醛肟. With a topological polar surface area (TPSA) of 45.5 Ų, 3-吡啶甲醛肟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-吡啶甲醛肟 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 3-吡啶甲醛肟?
The CAS number of 3-吡啶甲醛肟 is 1193-92-6.
What is the molecular formula of 3-吡啶甲醛肟?
The molecular formula of 3-吡啶甲醛肟 is C6H6N2O.
What is the molecular weight of 3-吡啶甲醛肟?
The molecular weight of 3-吡啶甲醛肟 is 122.05 g/mol.
Where can I buy 3-吡啶甲醛肟?
You can request a quote for 3-吡啶甲醛肟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-吡啶甲醛肟?
Yes, KEHONG BIO provides custom synthesis services for 3-吡啶甲醛肟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.