4-Iodobenzenesulfonyl chloride
TL;DR: 4-Iodobenzenesulfonyl chloride (CAS 98-61-3) is a chemical compound with molecular formula C6H4ClIO2S and molecular weight 301.86652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-iodobenzenesulfonyl chloride
Also Known As: 4-Iodobenzenesulfonyl chloride, Pipsyl chloride, Pipsyl choride, 4-iodobenzene-1-sulfonyl chloride, pipsylchloride
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H4ClIO2S |
| Molecular Weight | 301.86652 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.86652 Da |
| Heavy Atoms | 11 |
| Complexity | 213.0 |
| SMILES | C1=CC(=CC=C1S(=O)(=O)Cl)I |
| InChIKey | POXFXTSTVWDWIR-UHFFFAOYSA-N |
Product Description
Applications: 4-Iodobenzenesulfonyl chloride is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Iodobenzenesulfonyl chloride (CAS 98-61-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, 4-Iodobenzenesulfonyl chloride (CAS 98-61-3) has the molecular formula C6H4ClIO2S and a molecular weight of 301.87 g/mol. It is also known as 4-Iodobenzenesulfonyl chloride and Pipsyl chloride.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Iodobenzenesulfonyl chloride
Property Insights of 4-Iodobenzenesulfonyl chloride
The XLogP value of 3.0 indicates that 4-Iodobenzenesulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 4-Iodobenzenesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Iodobenzenesulfonyl chloride 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
What is the CAS number of 4-Iodobenzenesulfonyl chloride?
The CAS number of 4-Iodobenzenesulfonyl chloride is 98-61-3.
What is the molecular formula of 4-Iodobenzenesulfonyl chloride?
The molecular formula of 4-Iodobenzenesulfonyl chloride is C6H4ClIO2S.
What is the molecular weight of 4-Iodobenzenesulfonyl chloride?
The molecular weight of 4-Iodobenzenesulfonyl chloride is 301.86652 g/mol.
What are the applications of 4-Iodobenzenesulfonyl chloride?
4-Iodobenzenesulfonyl chloride is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Iodobenzenesulfonyl...
Where can I buy 4-Iodobenzenesulfonyl chloride?
You can request a quote for 4-Iodobenzenesulfonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Iodobenzenesulfonyl chloride?
Yes, CoreyChem provides custom synthesis services for 4-Iodobenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.