6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile
TL;DR: 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile (CAS 478049-81-9) is a chemical compound with molecular formula C18H11F3N2O and molecular weight 328.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-naphthalen-2-yloxy-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: 5N-397S, 6-methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile, 6-methyl-2-naphthalen-2-yloxy-4-(trifluoromethyl)pyridine-3-carbonitrile, 6-methyl-2-(naphthalen-2-yloxy)-4-(trifluoromethyl)pyridine-3-carbonitrile, 6-Methyl-2-(2-naphthalenyloxy)-4-(trifluoromethyl)-3-pyridinecarbonitrile
| Molecular Formula | C18H11F3N2O |
|---|---|
| Molecular Weight | 328.08 g/mol |
| LogP | 5.226 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.08234 |
| Heavy Atoms | 24 |
| Complexity | 958.6156 |
Chemical Identifiers
| CAS Number | 478049-81-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)OC2=CC3=CC=CC=C3C=C2)C#N)C(F)(F)F |
Product Overview
6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile (CAS 478049-81-9), with molecular formula C18H11F3N2O and molecular weight 328.08 g/mol. IUPAC: 6-methyl-2-naphthalen-2-yloxy-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile
Property Insights of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile
The XLogP value of 5.226 indicates that 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile?
The CAS number of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile is 478049-81-9.
What is the molecular formula of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile?
The molecular formula of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile is C18H11F3N2O.
What is the molecular weight of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile?
The molecular weight of 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile is 328.08 g/mol.
Where can I buy 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile?
You can request a quote for 6-Methyl-2-(2-naphthyloxy)-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 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-(2-naphthyloxy)-4-(trifluoromethyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.