3-Furanthiol
TL;DR: 3-Furanthiol (CAS 90590-04-8) 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-3-thiol
Also Known As: furan-3-thiol, 3-Furanthiol, 3-thiofuran
| Molecular Formula | C4H4OS |
|---|---|
| Molecular Weight | 100.00 g/mol |
| LogP | 1.6 |
| 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 | 90590-04-8 |
|---|---|
| SMILES | C1=COC=C1S |
| InChIKey | MWFFRFMPYAKXEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Furanthiol (CAS 90590-04-8), with molecular formula C4H4OS and molecular weight 100.00 g/mol. IUPAC: furan-3-thiol.
Chemical Property Profile of 3-Furanthiol
Property Insights of 3-Furanthiol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Furanthiol. With a topological polar surface area (TPSA) of 14.1 Ų, 3-Furanthiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-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 3-Furanthiol?
The CAS number of 3-Furanthiol is 90590-04-8.
What is the molecular formula of 3-Furanthiol?
The molecular formula of 3-Furanthiol is C4H4OS.
What is the molecular weight of 3-Furanthiol?
The molecular weight of 3-Furanthiol is 100.00 g/mol.
Where can I buy 3-Furanthiol?
You can request a quote for 3-Furanthiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Furanthiol?
Yes, KEHONG BIO provides custom synthesis services for 3-Furanthiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.