4-Iodobenzenesulfonyl chloride
TL;DR: 4-Iodobenzenesulfonyl chloride (CAS 98-61-3) is a chemical compound with molecular formula C6H4ClIO2S and molecular weight 301.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-iodobenzenesulfonyl chloride
Also Known As: 4-Iodobenzenesulfonyl chloride, Pipsyl chloride, Pipsyl choride, 4-iodobenzene-1-sulfonyl chloride, pipsylchloride
| Molecular Formula | C6H4ClIO2S |
|---|---|
| Molecular Weight | 301.87 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.86652 |
| Heavy Atoms | 11 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 98-61-3 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)Cl)I |
| InChIKey | POXFXTSTVWDWIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Iodobenzenesulfonyl chloride (CAS 98-61-3), with molecular formula C6H4ClIO2S and molecular weight 301.87 g/mol. IUPAC: 4-iodobenzenesulfonyl chloride.
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
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 301.87 g/mol.
Where can I buy 4-Iodobenzenesulfonyl chloride?
You can request a quote for 4-Iodobenzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Iodobenzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Iodobenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.