吡啶-3-醇-1-氧化物
TL;DR: 吡啶-3-醇-1-氧化物 (CAS 6602-28-4) is a chemical compound with molecular formula C5H5NO2 and molecular weight 111.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡啶-3-醇-1-氧化物
1-oxidopyridin-1-ium-3-ol
Also Known As: 3-Hydroxypyridine 1-oxide, 3-Pyridinol N-oxide, 3-Hydroxypyridine-N-oxide, 3-Hydroxypyridine N-oxide, Pyridin-3-ol 1-oxide
| Molecular Formula | C5H5NO2 |
|---|---|
| Molecular Weight | 111.03 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 45.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.03203 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 6602-28-4 |
|---|---|
| SMILES | C1=CC(=C[N+](=C1)[O-])O |
| InChIKey | YMEZKRMAPQIBQH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡啶-3-醇-1-氧化物 (CAS 6602-28-4), with molecular formula C5H5NO2 and molecular weight 111.03 g/mol. IUPAC: 1-oxidopyridin-1-ium-3-ol.
Chemical Property Profile of 吡啶-3-醇-1-氧化物
Property Insights of 吡啶-3-醇-1-氧化物
The XLogP value of -0.6 indicates that 吡啶-3-醇-1-氧化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.7 Ų, 吡啶-3-醇-1-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 吡啶-3-醇-1-氧化物 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 吡啶-3-醇-1-氧化物?
The CAS number of 吡啶-3-醇-1-氧化物 is 6602-28-4.
What is the molecular formula of 吡啶-3-醇-1-氧化物?
The molecular formula of 吡啶-3-醇-1-氧化物 is C5H5NO2.
What is the molecular weight of 吡啶-3-醇-1-氧化物?
The molecular weight of 吡啶-3-醇-1-氧化物 is 111.03 g/mol.
Where can I buy 吡啶-3-醇-1-氧化物?
You can request a quote for 吡啶-3-醇-1-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡啶-3-醇-1-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 吡啶-3-醇-1-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.