2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile
TL;DR: 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile (CAS 13600-42-5) is a chemical compound with molecular formula C7HCl2F3N2 and molecular weight 239.94688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dichloro-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: 2,6-dichloro-4-(trifluoromethyl)nicotinonitrile, 3-Cyano-2,6-dichloro-4-(trifluoromethyl)pyridine, C7HCl2F3N2, cis-3-Aminocyclobutanol, 2,6-dichloro-4-(trifluoromethyl)pyridine-3-carbonitrile
Technical Specifications
| Molecular Formula | C7HCl2F3N2 |
| Molecular Weight | 239.94688 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 239.94688 Da |
| Heavy Atoms | 14 |
| Complexity | 259.0 |
| SMILES | C1=C(C(=C(N=C1Cl)Cl)C#N)C(F)(F)F |
| InChIKey | WRXXBTBGBXYHSG-UHFFFAOYSA-N |
Chemical Property Profile of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile
Property Insights of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile
The XLogP value of 3.4 indicates that 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.7 Ų, 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile 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
What is the CAS number of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile?
The CAS number of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile is 13600-42-5.
What is the molecular formula of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile?
The molecular formula of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile is C7HCl2F3N2.
What is the molecular weight of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile?
The molecular weight of 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile is 239.94688 g/mol.
Where can I buy 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile?
You can request a quote for 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile?
Yes, CoreyChem provides custom synthesis services for 2,6-Dichloro-4-(trifluoromethyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.