4-Methoxybenzenesulfonyl chloride
TL;DR: 4-Methoxybenzenesulfonyl chloride (CAS 98-68-0) is a chemical compound with molecular formula C7H7ClO3S and molecular weight 205.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxybenzenesulfonyl chloride
Also Known As: 4-Methoxybenzenesulfonyl chloride, 4-Methoxybenzene-1-Sulfonyl Chloride, p-Anisylsulfonyl chloride, p-Anisolesulfonyl Chloride, Benzenesulfonyl chloride, 4-methoxy-
| Molecular Formula | C7H7ClO3S |
|---|---|
| Molecular Weight | 205.98 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.98044 |
| Heavy Atoms | 12 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 98-68-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)Cl |
| InChIKey | DTJVECUKADWGMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methoxybenzenesulfonyl chloride (CAS 98-68-0), with molecular formula C7H7ClO3S and molecular weight 205.98 g/mol. IUPAC: 4-methoxybenzenesulfonyl chloride.
Chemical Property Profile of 4-Methoxybenzenesulfonyl chloride
Property Insights of 4-Methoxybenzenesulfonyl chloride
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxybenzenesulfonyl chloride. With a topological polar surface area (TPSA) of 51.8 Ų, 4-Methoxybenzenesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxybenzenesulfonyl chloride has 0 hydrogen bond donor(s) and 3 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-Methoxybenzenesulfonyl chloride?
The CAS number of 4-Methoxybenzenesulfonyl chloride is 98-68-0.
What is the molecular formula of 4-Methoxybenzenesulfonyl chloride?
The molecular formula of 4-Methoxybenzenesulfonyl chloride is C7H7ClO3S.
What is the molecular weight of 4-Methoxybenzenesulfonyl chloride?
The molecular weight of 4-Methoxybenzenesulfonyl chloride is 205.98 g/mol.
Where can I buy 4-Methoxybenzenesulfonyl chloride?
You can request a quote for 4-Methoxybenzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxybenzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxybenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.