4-Fluorophenyl Chlorothionoformate
TL;DR: 4-Fluorophenyl Chlorothionoformate (CAS 42908-73-6) is a chemical compound with molecular formula C7H4ClFOS and molecular weight 189.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-(4-fluorophenyl) chloromethanethioate
Also Known As: 4-Fluorophenyl chlorothionoformate, O-(4-fluorophenyl) carbonochloridothioate, O-(4-fluorophenyl) chloromethanethioate, 4-fluorophenyl chlorothioformate, O-(4-Fluorophenyl) Chlorothioformate
| Molecular Formula | C7H4ClFOS |
|---|---|
| Molecular Weight | 189.97 g/mol |
| LogP | 2.7282 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.96555 |
| Heavy Atoms | 11 |
| Complexity | 259.648 |
Chemical Identifiers
| CAS Number | 42908-73-6 |
|---|---|
| SMILES | C1=CC(=CC=C1OC(=S)Cl)F |
Product Overview
4-Fluorophenyl Chlorothionoformate (CAS 42908-73-6), with molecular formula C7H4ClFOS and molecular weight 189.97 g/mol. IUPAC: O-(4-fluorophenyl) chloromethanethioate.
Chemical Property Profile of 4-Fluorophenyl Chlorothionoformate
Property Insights of 4-Fluorophenyl Chlorothionoformate
The XLogP value of 2.7282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorophenyl Chlorothionoformate. With a topological polar surface area (TPSA) of 9.23 Ų, 4-Fluorophenyl Chlorothionoformate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorophenyl Chlorothionoformate has 0 hydrogen bond donor(s) and 2 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-Fluorophenyl Chlorothionoformate?
The CAS number of 4-Fluorophenyl Chlorothionoformate is 42908-73-6.
What is the molecular formula of 4-Fluorophenyl Chlorothionoformate?
The molecular formula of 4-Fluorophenyl Chlorothionoformate is C7H4ClFOS.
What is the molecular weight of 4-Fluorophenyl Chlorothionoformate?
The molecular weight of 4-Fluorophenyl Chlorothionoformate is 189.97 g/mol.
Where can I buy 4-Fluorophenyl Chlorothionoformate?
You can request a quote for 4-Fluorophenyl Chlorothionoformate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorophenyl Chlorothionoformate?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorophenyl Chlorothionoformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.