2-Furanthiol
TL;DR: 2-Furanthiol (CAS 13129-35-6) is a chemical compound with molecular formula C4H4OS and molecular weight 100.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-2-thiol
Also Known As: Furan-2-thiol, 2-furanthiol, 2-Furfurylthiol, 2-furfuryl thiol, 2-mercapto furan
| Molecular Formula | C4H4OS |
|---|---|
| Molecular Weight | 100.00 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 14.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 99.99828 |
| Heavy Atoms | 6 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 13129-35-6 |
|---|---|
| SMILES | C1=COC(=C1)S |
| InChIKey | CMDKYFGIJALPLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Furanthiol (CAS 13129-35-6), with molecular formula C4H4OS and molecular weight 100.00 g/mol. IUPAC: furan-2-thiol.
Chemical Property Profile of 2-Furanthiol
Property Insights of 2-Furanthiol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Furanthiol. With a topological polar surface area (TPSA) of 14.1 Ų, 2-Furanthiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Furanthiol 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-Furanthiol?
The CAS number of 2-Furanthiol is 13129-35-6.
What is the molecular formula of 2-Furanthiol?
The molecular formula of 2-Furanthiol is C4H4OS.
What is the molecular weight of 2-Furanthiol?
The molecular weight of 2-Furanthiol is 100.00 g/mol.
Where can I buy 2-Furanthiol?
You can request a quote for 2-Furanthiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furanthiol?
Yes, KEHONG BIO provides custom synthesis services for 2-Furanthiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.