2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine
TL;DR: 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine (CAS 120776-55-8) is a chemical compound with molecular formula C13H5F4N and molecular weight 251.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetrafluoro-4-(2-phenylethynyl)pyridine
Also Known As: 2,3,5,6-tetrafluoro-4-(phenylethynyl)pyridine, 2,3,5,6-tetrafluoro-4-(2-phenylethynyl)pyridine, J2.093.935D, 4-(Phenylethynyl)-2,3,5,6-tetrafluoropyridine
| Molecular Formula | C13H5F4N |
|---|---|
| Molecular Weight | 251.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.03581 |
| Heavy Atoms | 18 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 120776-55-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC2=C(C(=NC(=C2F)F)F)F |
| InChIKey | YSBFDXVWEOTRHS-UHFFFAOYSA-N |
Product Overview
2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine (CAS 120776-55-8), with molecular formula C13H5F4N and molecular weight 251.04 g/mol. IUPAC: 2,3,5,6-tetrafluoro-4-(2-phenylethynyl)pyridine.
Chemical Property Profile of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine
Property Insights of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine
The XLogP value of 3.9 indicates that 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine has 0 hydrogen bond donor(s) and 5 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 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine?
The CAS number of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine is 120776-55-8.
What is the molecular formula of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine?
The molecular formula of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine is C13H5F4N.
What is the molecular weight of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine?
The molecular weight of 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine is 251.04 g/mol.
Where can I buy 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine?
You can request a quote for 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6-Tetrafluoro-4-(2-phenylethynyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.