2-(Methanesulfinyl)-2-methylpropanoic acid
TL;DR: 2-(Methanesulfinyl)-2-methylpropanoic acid (CAS 3680-05-5) is a chemical compound with molecular formula C5H10O3S and molecular weight 150.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-methylsulfinylpropanoic acid
Also Known As: 2-(Methylsulfinyl)isobutyric acid, 2-Methyl-2-(methylsulfinyl)propionic acid, 2-(Methanesulfinyl)-2-methylpropanoic acid, 2-methyl-2-methylsulfinylpropanoic acid, 2-methanesulfinyl-2-methylpropanoic acid
| Molecular Formula | C5H10O3S |
|---|---|
| Molecular Weight | 150.04 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.03506 |
| Heavy Atoms | 9 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 3680-05-5 |
|---|---|
| SMILES | CC(C)(C(=O)O)S(=O)C |
| InChIKey | HHHMVNNQYMVCJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Methanesulfinyl)-2-methylpropanoic acid (CAS 3680-05-5), with molecular formula C5H10O3S and molecular weight 150.04 g/mol. IUPAC: 2-methyl-2-methylsulfinylpropanoic acid.
Chemical Property Profile of 2-(Methanesulfinyl)-2-methylpropanoic acid
Property Insights of 2-(Methanesulfinyl)-2-methylpropanoic acid
The XLogP value of -0.3 indicates that 2-(Methanesulfinyl)-2-methylpropanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methanesulfinyl)-2-methylpropanoic acid. Following Lipinski's Rule of Five, 2-(Methanesulfinyl)-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-(Methanesulfinyl)-2-methylpropanoic acid?
The CAS number of 2-(Methanesulfinyl)-2-methylpropanoic acid is 3680-05-5.
What is the molecular formula of 2-(Methanesulfinyl)-2-methylpropanoic acid?
The molecular formula of 2-(Methanesulfinyl)-2-methylpropanoic acid is C5H10O3S.
What is the molecular weight of 2-(Methanesulfinyl)-2-methylpropanoic acid?
The molecular weight of 2-(Methanesulfinyl)-2-methylpropanoic acid is 150.04 g/mol.
Where can I buy 2-(Methanesulfinyl)-2-methylpropanoic acid?
You can request a quote for 2-(Methanesulfinyl)-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-(Methanesulfinyl)-2-methylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methanesulfinyl)-2-methylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.