2-羟基异烟酸
TL;DR: 2-羟基异烟酸 (CAS 10333-92-3) is a chemical compound with molecular formula C6H5NO3 and molecular weight 139.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-羟基异烟酸
2-oxo-1H-pyridine-4-carboxylic acid
Also Known As: 2-Hydroxyisonicotinic acid, 2-Hydroxy-4-pyridinecarboxylic acid, 2-oxo-1,2-dihydropyridine-4-carboxylic acid, 2-Hydroxy-isonicotinic acid, null
| Molecular Formula | C6H5NO3 |
|---|---|
| Molecular Weight | 139.03 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.02695 |
| Heavy Atoms | 10 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 10333-92-3 |
|---|---|
| SMILES | C1=CNC(=O)C=C1C(=O)O |
| InChIKey | BXHCJLRTXPHUGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-羟基异烟酸 (CAS 10333-92-3), with molecular formula C6H5NO3 and molecular weight 139.03 g/mol. IUPAC: 2-oxo-1H-pyridine-4-carboxylic acid.
Chemical Property Profile of 2-羟基异烟酸
Property Insights of 2-羟基异烟酸
The XLogP value of -0.5 indicates that 2-羟基异烟酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-羟基异烟酸. Following Lipinski's Rule of Five, 2-羟基异烟酸 has 2 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-羟基异烟酸?
The CAS number of 2-羟基异烟酸 is 10333-92-3.
What is the molecular formula of 2-羟基异烟酸?
The molecular formula of 2-羟基异烟酸 is C6H5NO3.
What is the molecular weight of 2-羟基异烟酸?
The molecular weight of 2-羟基异烟酸 is 139.03 g/mol.
Where can I buy 2-羟基异烟酸?
You can request a quote for 2-羟基异烟酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-羟基异烟酸?
Yes, KEHONG BIO provides custom synthesis services for 2-羟基异烟酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.