1-Methylthioethanethiol
TL;DR: 1-Methylthioethanethiol (CAS 31332-16-8) is a chemical compound with molecular formula C3H8S2 and molecular weight 108.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfanylethanethiol
Also Known As: 1-(methylthio)ethanethiol, 1-Methylthioethanethiol, 1-methylsulfanylethanethiol, 2-Thiabutane-3-thiol, 1-Methylthioethanthiol
| Molecular Formula | C3H8S2 |
|---|---|
| Molecular Weight | 108.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 108.006744 |
| Heavy Atoms | 5 |
| Complexity | 20.0 |
Chemical Identifiers
| CAS Number | 31332-16-8 |
|---|---|
| SMILES | CC(S)SC |
| InChIKey | GHIADNFHCKUPJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methylthioethanethiol (CAS 31332-16-8), with molecular formula C3H8S2 and molecular weight 108.01 g/mol. IUPAC: 1-methylsulfanylethanethiol.
Chemical Property Profile of 1-Methylthioethanethiol
Property Insights of 1-Methylthioethanethiol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylthioethanethiol. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Methylthioethanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylthioethanethiol 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 1-Methylthioethanethiol?
The CAS number of 1-Methylthioethanethiol is 31332-16-8.
What is the molecular formula of 1-Methylthioethanethiol?
The molecular formula of 1-Methylthioethanethiol is C3H8S2.
What is the molecular weight of 1-Methylthioethanethiol?
The molecular weight of 1-Methylthioethanethiol is 108.01 g/mol.
Where can I buy 1-Methylthioethanethiol?
You can request a quote for 1-Methylthioethanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylthioethanethiol?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylthioethanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.