![4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate structure](/static/products/6818/681844-10-0.webp)
4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate
TL;DR: 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate (CAS 681844-10-0) is a chemical compound with molecular formula C21H19Cl2NO4S and molecular weight 451.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl] 4-tert-butylbenzenesulfonate
Also Known As: A2901/0122213, 4-[(3,5-dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate, [4-(3,5-dichloropyridin-2-yl)oxyphenyl] 4-tert-butylbenzenesulfonate, 4-[(3,5-dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzene-1-sulfonate
| Molecular Formula | C21H19Cl2NO4S |
|---|---|
| Molecular Weight | 451.04 g/mol |
| LogP | 6.2459 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.0412 |
| Heavy Atoms | 29 |
| Complexity | 1106.9132 |
Chemical Identifiers
| CAS Number | 681844-10-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)OC3=C(C=C(C=N3)Cl)Cl |
Product Overview
4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate (CAS 681844-10-0), with molecular formula C21H19Cl2NO4S and molecular weight 451.04 g/mol. IUPAC: [4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl] 4-tert-butylbenzenesulfonate.
Chemical Property Profile of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate
Property Insights of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate
The XLogP value of 6.2459 indicates that 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate 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 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate. Following Lipinski's Rule of Five, 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate 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 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate?
The CAS number of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate is 681844-10-0.
What is the molecular formula of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate?
The molecular formula of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate is C21H19Cl2NO4S.
What is the molecular weight of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate?
The molecular weight of 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate is 451.04 g/mol.
Where can I buy 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate?
You can request a quote for 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,5-Dichloropyridin-2-yl)oxy]phenyl 4-tert-butylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.