2-Methylpropane-2-sulfonic acid
TL;DR: 2-Methylpropane-2-sulfonic acid (CAS 16794-13-1) is a chemical compound with molecular formula C4H10O3S and molecular weight 138.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methylpropane-2-sulfonic acid
Also Known As: 2-methylpropane-2-sulfonic acid, 2-Propanesulfonic acid, 2-methyl-, 2-methyl-2-propanesulfonic acid, 1,1-dimethyl-1-ethanesulfonic acid, J1.263.735G
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H10O3S |
| Molecular Weight | 138.03506 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.03506 Da |
| Heavy Atoms | 8 |
| Complexity | 155.0 |
| SMILES | CC(C)(C)S(=O)(=O)O |
| InChIKey | XCJGLBWDZKLQCY-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methylpropane-2-sulfonic acid
Property Insights of 2-Methylpropane-2-sulfonic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylpropane-2-sulfonic acid. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylpropane-2-sulfonic acid. Following Lipinski's Rule of Five, 2-Methylpropane-2-sulfonic 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 2-Methylpropane-2-sulfonic acid?
The CAS number of 2-Methylpropane-2-sulfonic acid is 16794-13-1.
What is the molecular formula of 2-Methylpropane-2-sulfonic acid?
The molecular formula of 2-Methylpropane-2-sulfonic acid is C4H10O3S.
What is the molecular weight of 2-Methylpropane-2-sulfonic acid?
The molecular weight of 2-Methylpropane-2-sulfonic acid is 138.03506 g/mol.
Where can I buy 2-Methylpropane-2-sulfonic acid?
You can request a quote for 2-Methylpropane-2-sulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methylpropane-2-sulfonic acid?
Yes, CoreyChem provides custom synthesis services for 2-Methylpropane-2-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.