2-(2-Buten-1-ylthio)ethanol
TL;DR: 2-(2-Buten-1-ylthio)ethanol (CAS 82010-89-7) is a chemical compound with molecular formula C6H12OS and molecular weight 132.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-but-2-enylsulfanylethanol
Also Known As: 2-(2-Buten-1-ylthio)ethanol, Ethanol,2-(2-buten-1-ylthio)-, 2-[(But-2-en-1-yl)sulfanyl]ethan-1-ol
| Molecular Formula | C6H12OS |
|---|---|
| Molecular Weight | 132.06 g/mol |
| LogP | 1.288 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 132.06088 |
| Heavy Atoms | 8 |
| Complexity | 61.548874 |
Chemical Identifiers
| CAS Number | 82010-89-7 |
|---|---|
| SMILES | CC=CCSCCO |
Product Overview
2-(2-Buten-1-ylthio)ethanol (CAS 82010-89-7), with molecular formula C6H12OS and molecular weight 132.06 g/mol. IUPAC: 2-but-2-enylsulfanylethanol.
Chemical Property Profile of 2-(2-Buten-1-ylthio)ethanol
Property Insights of 2-(2-Buten-1-ylthio)ethanol
The XLogP value of 1.288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Buten-1-ylthio)ethanol. With a topological polar surface area (TPSA) of 20.23 Ų, 2-(2-Buten-1-ylthio)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Buten-1-ylthio)ethanol has 1 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-(2-Buten-1-ylthio)ethanol?
The CAS number of 2-(2-Buten-1-ylthio)ethanol is 82010-89-7.
What is the molecular formula of 2-(2-Buten-1-ylthio)ethanol?
The molecular formula of 2-(2-Buten-1-ylthio)ethanol is C6H12OS.
What is the molecular weight of 2-(2-Buten-1-ylthio)ethanol?
The molecular weight of 2-(2-Buten-1-ylthio)ethanol is 132.06 g/mol.
Where can I buy 2-(2-Buten-1-ylthio)ethanol?
You can request a quote for 2-(2-Buten-1-ylthio)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Buten-1-ylthio)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Buten-1-ylthio)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.