2-Mercapto-2-ethyl butyric acid
TL;DR: 2-Mercapto-2-ethyl butyric acid (CAS 52988-77-9) is a chemical compound with molecular formula C6H12O2S and molecular weight 148.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-2-sulfanylbutanoic acid
Also Known As: 2-ethyl-2-mercapto-butyric acid, 2-mercapto-2-ethyl butyric acid, 2-Aethyl-2-mercapto-buttersaeure, 2-ethyl-2-sulfanyl-butanoic Acid, 5-(2-CHLORO-6-METHYLPHENYL)-2H-1,2,3,4-TETRAAZOLE
| Molecular Formula | C6H12O2S |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | 1.5596 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.0558 |
| Heavy Atoms | 9 |
| Complexity | 107.62549 |
Chemical Identifiers
| CAS Number | 52988-77-9 |
|---|---|
| SMILES | CCC(CC)(C(=O)O)S |
Product Overview
2-Mercapto-2-ethyl butyric acid (CAS 52988-77-9), with molecular formula C6H12O2S and molecular weight 148.06 g/mol. IUPAC: 2-ethyl-2-sulfanylbutanoic acid.
Chemical Property Profile of 2-Mercapto-2-ethyl butyric acid
Property Insights of 2-Mercapto-2-ethyl butyric acid
The XLogP value of 1.5596 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Mercapto-2-ethyl butyric acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Mercapto-2-ethyl butyric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Mercapto-2-ethyl butyric acid has 2 hydrogen bond donor(s) and 2 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-Mercapto-2-ethyl butyric acid?
The CAS number of 2-Mercapto-2-ethyl butyric acid is 52988-77-9.
What is the molecular formula of 2-Mercapto-2-ethyl butyric acid?
The molecular formula of 2-Mercapto-2-ethyl butyric acid is C6H12O2S.
What is the molecular weight of 2-Mercapto-2-ethyl butyric acid?
The molecular weight of 2-Mercapto-2-ethyl butyric acid is 148.06 g/mol.
Where can I buy 2-Mercapto-2-ethyl butyric acid?
You can request a quote for 2-Mercapto-2-ethyl butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Mercapto-2-ethyl butyric acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Mercapto-2-ethyl butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.