4-Methoxyphenyl 4-fluorobenzenesulfonate
TL;DR: 4-Methoxyphenyl 4-fluorobenzenesulfonate (CAS 161912-34-1) is a chemical compound with molecular formula C13H11FO4S and molecular weight 282.0362 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methoxyphenyl) 4-fluorobenzenesulfonate
Also Known As: 4-methoxyphenyl 4-fluorobenzenesulfonate, (4-methoxyphenyl) 4-fluorobenzenesulfonate, 4-methoxyphenyl 4-fluorobenzene-1-sulfonate, J2.388.122E, 4-Fluorobenzenesulfonic acid 4-methoxyphenyl ester
Technical Specifications
| Molecular Formula | C13H11FO4S |
| Molecular Weight | 282.0362 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.0362 Da |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
| SMILES | COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F |
| InChIKey | HTHDRBATKQIQKB-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methoxyphenyl 4-fluorobenzenesulfonate
Property Insights of 4-Methoxyphenyl 4-fluorobenzenesulfonate
The XLogP value of 3.1 indicates that 4-Methoxyphenyl 4-fluorobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxyphenyl 4-fluorobenzenesulfonate. Following Lipinski's Rule of Five, 4-Methoxyphenyl 4-fluorobenzenesulfonate 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 4-Methoxyphenyl 4-fluorobenzenesulfonate?
The CAS number of 4-Methoxyphenyl 4-fluorobenzenesulfonate is 161912-34-1.
What is the molecular formula of 4-Methoxyphenyl 4-fluorobenzenesulfonate?
The molecular formula of 4-Methoxyphenyl 4-fluorobenzenesulfonate is C13H11FO4S.
What is the molecular weight of 4-Methoxyphenyl 4-fluorobenzenesulfonate?
The molecular weight of 4-Methoxyphenyl 4-fluorobenzenesulfonate is 282.0362 g/mol.
Where can I buy 4-Methoxyphenyl 4-fluorobenzenesulfonate?
You can request a quote for 4-Methoxyphenyl 4-fluorobenzenesulfonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methoxyphenyl 4-fluorobenzenesulfonate?
Yes, CoreyChem provides custom synthesis services for 4-Methoxyphenyl 4-fluorobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.