![3-[2-(4-Chlorophenyl)ethynyl]pyridine structure](/static/products/676/676562-55-3.png)
3-[2-(4-Chlorophenyl)ethynyl]pyridine
TL;DR: 3-[2-(4-Chlorophenyl)ethynyl]pyridine (CAS 676562-55-3) is a chemical compound with molecular formula C13H8ClN and molecular weight 213.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-chlorophenyl)ethynyl]pyridine
Also Known As: 3-[2-(4-chlorophenyl)ethynyl]pyridine, 3-((4-chlorophenyl)ethynyl)pyridine, 3-[2-(4-chlorophenyl)ethynyl]-pyridine, 1-(3-Pyridyl)-2-(4-chlorophenyl)ethyne, J2.376.316H
| Molecular Formula | C13H8ClN |
|---|---|
| Molecular Weight | 213.03 g/mol |
| LogP | 3.1348 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.03453 |
| Heavy Atoms | 15 |
| Complexity | 491.55432 |
Chemical Identifiers
| CAS Number | 676562-55-3 |
|---|---|
| SMILES | C1=CC(=CN=C1)C#CC2=CC=C(C=C2)Cl |
Product Overview
3-[2-(4-Chlorophenyl)ethynyl]pyridine (CAS 676562-55-3), with molecular formula C13H8ClN and molecular weight 213.03 g/mol. IUPAC: 3-[2-(4-chlorophenyl)ethynyl]pyridine.
Chemical Property Profile of 3-[2-(4-Chlorophenyl)ethynyl]pyridine
Property Insights of 3-[2-(4-Chlorophenyl)ethynyl]pyridine
The XLogP value of 3.1348 indicates that 3-[2-(4-Chlorophenyl)ethynyl]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 3-[2-(4-Chlorophenyl)ethynyl]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(4-Chlorophenyl)ethynyl]pyridine has 0 hydrogen bond donor(s) and 1 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 3-[2-(4-Chlorophenyl)ethynyl]pyridine?
The CAS number of 3-[2-(4-Chlorophenyl)ethynyl]pyridine is 676562-55-3.
What is the molecular formula of 3-[2-(4-Chlorophenyl)ethynyl]pyridine?
The molecular formula of 3-[2-(4-Chlorophenyl)ethynyl]pyridine is C13H8ClN.
What is the molecular weight of 3-[2-(4-Chlorophenyl)ethynyl]pyridine?
The molecular weight of 3-[2-(4-Chlorophenyl)ethynyl]pyridine is 213.03 g/mol.
Where can I buy 3-[2-(4-Chlorophenyl)ethynyl]pyridine?
You can request a quote for 3-[2-(4-Chlorophenyl)ethynyl]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-Chlorophenyl)ethynyl]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-Chlorophenyl)ethynyl]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.