异烟酸
TL;DR: 异烟酸 (CAS 55-22-1) is a chemical compound with molecular formula C6H5NO2 and molecular weight 123.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异烟酸
pyridine-4-carboxylic acid
Also Known As: ISONICOTINIC ACID, 4-Pyridinecarboxylic acid, Pyridine-4-carboxylic acid, 4-Picolinic acid, 4-Carboxypyridine
| Molecular Formula | C6H5NO2 |
|---|---|
| Molecular Weight | 123.03 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 123.03203 |
| Heavy Atoms | 9 |
| Complexity | 108.0 |
| Vapor Pressure | 0.00789 [mmHg] |
Chemical Identifiers
| CAS Number | 55-22-1 |
|---|---|
| SMILES | C1=CN=CC=C1C(=O)O |
| InChIKey | TWBYWOBDOCUKOW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异烟酸 (CAS 55-22-1), with molecular formula C6H5NO2 and molecular weight 123.03 g/mol. IUPAC: pyridine-4-carboxylic acid.
Chemical Property Profile of 异烟酸
Property Insights of 异烟酸
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异烟酸. With a topological polar surface area (TPSA) of 50.2 Ų, 异烟酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异烟酸 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 异烟酸?
The CAS number of 异烟酸 is 55-22-1.
What is the molecular formula of 异烟酸?
The molecular formula of 异烟酸 is C6H5NO2.
What is the molecular weight of 异烟酸?
The molecular weight of 异烟酸 is 123.03 g/mol.
Where can I buy 异烟酸?
You can request a quote for 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 异烟酸?
Yes, KEHONG BIO provides custom synthesis services for 异烟酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.