2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile
TL;DR: 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile (CAS 478049-48-8) is a chemical compound with molecular formula C10H6ClF3N2 and molecular weight 246.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6-cyclopropyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: 2-chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile, 2-chloro-6-cyclopropyl-4-(trifluoromethyl)pyridine-3-carbonitrile, 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)-nicotinonitrile, chlorocyclopropyltrifluoromethylnicotinonitrile, 2-Chloro-3-cyano-6-cyclopropyl-4-(trifluoromethyl)pyridine
| Molecular Formula | C10H6ClF3N2 |
|---|---|
| Molecular Weight | 246.02 g/mol |
| LogP | 3.50288 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.01717 |
| Heavy Atoms | 16 |
| Complexity | 472.1781 |
Chemical Identifiers
| CAS Number | 478049-48-8 |
|---|---|
| SMILES | C1CC1C2=NC(=C(C(=C2)C(F)(F)F)C#N)Cl |
Product Overview
2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile (CAS 478049-48-8), with molecular formula C10H6ClF3N2 and molecular weight 246.02 g/mol. IUPAC: 2-chloro-6-cyclopropyl-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile
Property Insights of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile
The XLogP value of 3.50288 indicates that 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile has 0 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 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile?
The CAS number of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile is 478049-48-8.
What is the molecular formula of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile?
The molecular formula of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile is C10H6ClF3N2.
What is the molecular weight of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile?
The molecular weight of 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile is 246.02 g/mol.
Where can I buy 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile?
You can request a quote for 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-6-cyclopropyl-4-(trifluoromethyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.