4-(Trifluoromethyl)pyridine
TL;DR: 4-(Trifluoromethyl)pyridine (CAS 3796-24-5) is a chemical compound with molecular formula C6H4F3N and molecular weight 147.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(trifluoromethyl)pyridine
Also Known As: 4-(Trifluoromethyl)pyridine, 4-trifluoromethylpyridine, Pyridine, 4-(trifluoromethyl)-, Pyridine, 4-trifluoromethyl-, 4-trifluoromethyl-pyridine
| Molecular Formula | C6H4F3N |
|---|---|
| Molecular Weight | 147.03 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.02959 |
| Heavy Atoms | 10 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 3796-24-5 |
|---|---|
| SMILES | C1=CN=CC=C1C(F)(F)F |
| InChIKey | IIYVNMXPYWIJBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Trifluoromethyl)pyridine (CAS 3796-24-5), with molecular formula C6H4F3N and molecular weight 147.03 g/mol. IUPAC: 4-(trifluoromethyl)pyridine.
Chemical Property Profile of 4-(Trifluoromethyl)pyridine
Property Insights of 4-(Trifluoromethyl)pyridine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Trifluoromethyl)pyridine. With a topological polar surface area (TPSA) of 12.9 Ų, 4-(Trifluoromethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Trifluoromethyl)pyridine has 0 hydrogen bond donor(s) and 4 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-(Trifluoromethyl)pyridine?
The CAS number of 4-(Trifluoromethyl)pyridine is 3796-24-5.
What is the molecular formula of 4-(Trifluoromethyl)pyridine?
The molecular formula of 4-(Trifluoromethyl)pyridine is C6H4F3N.
What is the molecular weight of 4-(Trifluoromethyl)pyridine?
The molecular weight of 4-(Trifluoromethyl)pyridine is 147.03 g/mol.
Where can I buy 4-(Trifluoromethyl)pyridine?
You can request a quote for 4-(Trifluoromethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Trifluoromethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Trifluoromethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.