![3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate structure](/static/products/3390/339026-70-9.webp)
3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate
TL;DR: 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate (CAS 339026-70-9) is a chemical compound with molecular formula C18H10Cl2F3NO4S and molecular weight 462.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl] 2-chlorobenzenesulfonate
Also Known As: 8F-040, 3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate, [3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 2-chlorobenzenesulfonate, 3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl 2-chlorobenzene-1-sulfonate, 3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl2-chlorobenzene-1-sulfonate
| Molecular Formula | C18H10Cl2F3NO4S |
|---|---|
| Molecular Weight | 462.97 g/mol |
| LogP | 5.9672 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 462.96597 |
| Heavy Atoms | 29 |
| Complexity | 1153.8384 |
Chemical Identifiers
| CAS Number | 339026-70-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)S(=O)(=O)OC2=CC=CC(=C2)OC3=C(C=C(C=N3)C(F)(F)F)Cl)Cl |
Product Overview
3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate (CAS 339026-70-9), with molecular formula C18H10Cl2F3NO4S and molecular weight 462.97 g/mol. IUPAC: [3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl] 2-chlorobenzenesulfonate.
Chemical Property Profile of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate
Property Insights of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate
The XLogP value of 5.9672 indicates that 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate. Following Lipinski's Rule of Five, 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate?
The CAS number of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate is 339026-70-9.
What is the molecular formula of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate?
The molecular formula of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate is C18H10Cl2F3NO4S.
What is the molecular weight of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate?
The molecular weight of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate is 462.97 g/mol.
Where can I buy 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate?
You can request a quote for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl 2-chlorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.