4-吡啶酮
TL;DR: 4-吡啶酮 (CAS 626-64-2) is a chemical compound with molecular formula C5H5NO and molecular weight 95.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-吡啶酮
1H-pyridin-4-one
Also Known As: 4-HYDROXYPYRIDINE, pyridin-4-ol, 4-Pyridinol, pyridin-4(1H)-one, 4-Pyridone
| Molecular Formula | C5H5NO |
|---|---|
| Molecular Weight | 95.04 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 95.03712 |
| Heavy Atoms | 7 |
| Complexity | 121.0 |
| Vapor Pressure | 0.39 [mmHg] |
Chemical Identifiers
| CAS Number | 626-64-2 |
|---|---|
| SMILES | C1=CNC=CC1=O |
| InChIKey | GCNTZFIIOFTKIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-吡啶酮 (CAS 626-64-2), with molecular formula C5H5NO and molecular weight 95.04 g/mol. IUPAC: 1H-pyridin-4-one.
Chemical Property Profile of 4-吡啶酮
Property Insights of 4-吡啶酮
The XLogP value of -1.3 indicates that 4-吡啶酮 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.1 Ų, 4-吡啶酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-吡啶酮 has 1 hydrogen bond donor(s) and 2 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 4-吡啶酮?
The CAS number of 4-吡啶酮 is 626-64-2.
What is the molecular formula of 4-吡啶酮?
The molecular formula of 4-吡啶酮 is C5H5NO.
What is the molecular weight of 4-吡啶酮?
The molecular weight of 4-吡啶酮 is 95.04 g/mol.
Where can I buy 4-吡啶酮?
You can request a quote for 4-吡啶酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-吡啶酮?
Yes, KEHONG BIO provides custom synthesis services for 4-吡啶酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.