2-Methanesulfonyl-2-methylpropanoic acid
TL;DR: 2-Methanesulfonyl-2-methylpropanoic acid (CAS 3534-81-4) is a chemical compound with molecular formula C5H10O4S and molecular weight 166.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-methylsulfonylpropanoic acid
Also Known As: 2-methanesulfonyl-2-methylpropanoic acid, 2-methyl-2-(methylsulfonyl)propanoic acid, 2-methyl-2-methylsulfonylpropanoic acid, Propionic acid, 2-methyl-2-(methylsulfonyl)-, 2-Methyl-2-(methylsulfonyl)propionic acid
| Molecular Formula | C5H10O4S |
|---|---|
| Molecular Weight | 166.03 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.02998 |
| Heavy Atoms | 10 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 3534-81-4 |
|---|---|
| SMILES | CC(C)(C(=O)O)S(=O)(=O)C |
| InChIKey | LVWJRYVSTKPXMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methanesulfonyl-2-methylpropanoic acid (CAS 3534-81-4), with molecular formula C5H10O4S and molecular weight 166.03 g/mol. IUPAC: 2-methyl-2-methylsulfonylpropanoic acid.
Chemical Property Profile of 2-Methanesulfonyl-2-methylpropanoic acid
Property Insights of 2-Methanesulfonyl-2-methylpropanoic acid
The XLogP value of -0.2 indicates that 2-Methanesulfonyl-2-methylpropanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methanesulfonyl-2-methylpropanoic acid. Following Lipinski's Rule of Five, 2-Methanesulfonyl-2-methylpropanoic acid has 1 hydrogen bond donor(s) and 4 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 2-Methanesulfonyl-2-methylpropanoic acid?
The CAS number of 2-Methanesulfonyl-2-methylpropanoic acid is 3534-81-4.
What is the molecular formula of 2-Methanesulfonyl-2-methylpropanoic acid?
The molecular formula of 2-Methanesulfonyl-2-methylpropanoic acid is C5H10O4S.
What is the molecular weight of 2-Methanesulfonyl-2-methylpropanoic acid?
The molecular weight of 2-Methanesulfonyl-2-methylpropanoic acid is 166.03 g/mol.
Where can I buy 2-Methanesulfonyl-2-methylpropanoic acid?
You can request a quote for 2-Methanesulfonyl-2-methylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methanesulfonyl-2-methylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methanesulfonyl-2-methylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.