4-Isopropylbenzenesulfonic acid
TL;DR: 4-Isopropylbenzenesulfonic acid (CAS 16066-35-6) is a chemical compound with molecular formula C9H12O3S and molecular weight 200.05072 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-propan-2-ylbenzenesulfonic acid
Also Known As: 4-isopropylbenzenesulfonic acid, p-Cumenesulphonic acid, p-cumenesulfonic acid, Cumenesulphonic acid, Cumenesulfonic acid
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12O3S |
| Molecular Weight | 200.05072 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.05072 Da |
| Heavy Atoms | 13 |
| Complexity | 243.0 |
| SMILES | CC(C)C1=CC=C(C=C1)S(=O)(=O)O |
| InChIKey | CVLHGLWXLDOELD-UHFFFAOYSA-N |
Product Description
Applications: 4-Isopropylbenzenesulfonic acid is used in surfactant and detergent formulations, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-Isopropylbenzenesulfonic acid is a surfactant raw material identified by CAS number 16066-35-6 and the molecular formula C9H12O3S and a molecular weight of 200.05 g/mol. Synonyms include 4-isopropylbenzenesulfonic acid and p-Cumenesulphonic acid.
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-Isopropylbenzenesulfonic acid
Property Insights of 4-Isopropylbenzenesulfonic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Isopropylbenzenesulfonic acid. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Isopropylbenzenesulfonic acid. Following Lipinski's Rule of Five, 4-Isopropylbenzenesulfonic acid has 1 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-Isopropylbenzenesulfonic acid?
The CAS number of 4-Isopropylbenzenesulfonic acid is 16066-35-6.
What is the molecular formula of 4-Isopropylbenzenesulfonic acid?
The molecular formula of 4-Isopropylbenzenesulfonic acid is C9H12O3S.
What is the molecular weight of 4-Isopropylbenzenesulfonic acid?
The molecular weight of 4-Isopropylbenzenesulfonic acid is 200.05072 g/mol.
What are the applications of 4-Isopropylbenzenesulfonic acid?
4-Isopropylbenzenesulfonic acid is used in surfactant and detergent formulations, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project...
Where can I buy 4-Isopropylbenzenesulfonic acid?
You can request a quote for 4-Isopropylbenzenesulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Isopropylbenzenesulfonic acid?
Yes, CoreyChem provides custom synthesis services for 4-Isopropylbenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.