4-Methoxybenzenesulfonyl chloride
TL;DR: 4-Methoxybenzenesulfonyl chloride (CAS 98-68-0) is a chemical compound with molecular formula C7H7ClO3S and molecular weight 205.98044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxybenzenesulfonyl chloride
Also Known As: 4-Methoxybenzenesulfonyl chloride, 4-Methoxybenzene-1-Sulfonyl Chloride, p-Anisylsulfonyl chloride, p-Anisolesulfonyl Chloride, Benzenesulfonyl chloride, 4-methoxy-
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H7ClO3S |
| Molecular Weight | 205.98044 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.98044 Da |
| Heavy Atoms | 12 |
| Complexity | 224.0 |
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)Cl |
| InChIKey | DTJVECUKADWGMO-UHFFFAOYSA-N |
Product Description
Applications: 4-Methoxybenzenesulfonyl 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-Methoxybenzenesulfonyl chloride (CAS 98-68-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4-Methoxybenzenesulfonyl chloride (CAS 98-68-0) is a heterocyclic building block with the molecular formula C7H7ClO3S and a molecular weight of 205.98 g/mol. It is also known as 4-Methoxybenzenesulfonyl chloride and 4-Methoxybenzene-1-Sulfonyl 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-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
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 205.98044 g/mol.
What are the applications of 4-Methoxybenzenesulfonyl chloride?
4-Methoxybenzenesulfonyl 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...
Where can I buy 4-Methoxybenzenesulfonyl chloride?
You can request a quote for 4-Methoxybenzenesulfonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methoxybenzenesulfonyl chloride?
Yes, CoreyChem provides custom synthesis services for 4-Methoxybenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.