4-Phenylnicotinic acid
TL;DR: 4-Phenylnicotinic acid (CAS 103863-14-5) is a chemical compound with molecular formula C12H9NO2 and molecular weight 199.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenylpyridine-3-carboxylic acid
Also Known As: 4-PHENYLNICOTINIC ACID, 4-phenylpyridine-3-carboxylic Acid, 4-Phenylnicotinicacid, Biphenyl-2-carboxylic?acid, 4-Phenylpyridin-3-carbonsaeure
| Molecular Formula | C12H9NO2 |
|---|---|
| Molecular Weight | 199.06 g/mol |
| LogP | 2.4468 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.06332 |
| Heavy Atoms | 15 |
| Complexity | 479.9906 |
Chemical Identifiers
| CAS Number | 103863-14-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C=NC=C2)C(=O)O |
Product Overview
4-Phenylnicotinic acid (CAS 103863-14-5), with molecular formula C12H9NO2 and molecular weight 199.06 g/mol. IUPAC: 4-phenylpyridine-3-carboxylic acid.
Chemical Property Profile of 4-Phenylnicotinic acid
Property Insights of 4-Phenylnicotinic acid
The XLogP value of 2.4468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylnicotinic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 4-Phenylnicotinic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylnicotinic acid 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-Phenylnicotinic acid?
The CAS number of 4-Phenylnicotinic acid is 103863-14-5.
What is the molecular formula of 4-Phenylnicotinic acid?
The molecular formula of 4-Phenylnicotinic acid is C12H9NO2.
What is the molecular weight of 4-Phenylnicotinic acid?
The molecular weight of 4-Phenylnicotinic acid is 199.06 g/mol.
Where can I buy 4-Phenylnicotinic acid?
You can request a quote for 4-Phenylnicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylnicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylnicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.