2-Thiophenethiol
TL;DR: 2-Thiophenethiol (CAS 70688-48-1) is a chemical compound with molecular formula C4H4S2 and molecular weight 115.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thiophene-2-thiol
Also Known As: Thiophene-2-thiol, 2-Thiophenethiol, 2-Mercaptothiophene, thiophenethiol, 2-Thienyl mercaptan
| Molecular Formula | C4H4S2 |
|---|---|
| Molecular Weight | 115.98 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 29.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 115.97544 |
| Heavy Atoms | 6 |
| Complexity | 44.0 |
Chemical Identifiers
| CAS Number | 70688-48-1 |
|---|---|
| SMILES | C1=CSC(=C1)S |
| InChIKey | SWEDAZLCYJDAGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Thiophenethiol (CAS 70688-48-1), with molecular formula C4H4S2 and molecular weight 115.98 g/mol. IUPAC: thiophene-2-thiol.
Chemical Property Profile of 2-Thiophenethiol
Property Insights of 2-Thiophenethiol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Thiophenethiol. With a topological polar surface area (TPSA) of 29.2 Ų, 2-Thiophenethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thiophenethiol 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-Thiophenethiol?
The CAS number of 2-Thiophenethiol is 70688-48-1.
What is the molecular formula of 2-Thiophenethiol?
The molecular formula of 2-Thiophenethiol is C4H4S2.
What is the molecular weight of 2-Thiophenethiol?
The molecular weight of 2-Thiophenethiol is 115.98 g/mol.
Where can I buy 2-Thiophenethiol?
You can request a quote for 2-Thiophenethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiophenethiol?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiophenethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.