4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol
TL;DR: 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol (CAS 69045-85-8) is a chemical compound with molecular formula C12H8F3NO2 and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenol
Also Known As: 4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenol, 4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenol, Maybridge3_004426, Fluazifop-P-butyl metabolite, Fluazifop-P-butyl metabolite 4
| Molecular Formula | C12H8F3NO2 |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.05072 |
| Heavy Atoms | 18 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 69045-85-8 |
|---|---|
| SMILES | C1=CC(=CC=C1O)OC2=NC=C(C=C2)C(F)(F)F |
| InChIKey | LXXDBPUREVMTMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol (CAS 69045-85-8), with molecular formula C12H8F3NO2 and molecular weight 255.05 g/mol. IUPAC: 4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenol.
Chemical Property Profile of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol
Property Insights of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol. With a topological polar surface area (TPSA) of 42.4 Ų, 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol has 1 hydrogen bond donor(s) and 6 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-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol?
The CAS number of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol is 69045-85-8.
What is the molecular formula of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol?
The molecular formula of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol is C12H8F3NO2.
What is the molecular weight of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol?
The molecular weight of 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol is 255.05 g/mol.
Where can I buy 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol?
You can request a quote for 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(5-Trifluoromethyl-pyridin-2-yloxy)-phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.