1,3-Dithian-5-ol
TL;DR: 1,3-Dithian-5-ol (CAS 908-35-0) is a chemical compound with molecular formula C4H8OS2 and molecular weight 136.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dithian-5-ol
Also Known As: 1,3-dithian-5-ol, 5-hydroxy-1,3-dithiane, KST-1B9162
| Molecular Formula | C4H8OS2 |
|---|---|
| Molecular Weight | 136.00 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.00166 |
| Heavy Atoms | 7 |
| Complexity | 51.0 |
Chemical Identifiers
| CAS Number | 908-35-0 |
|---|---|
| SMILES | C1C(CSCS1)O |
| InChIKey | OLPTZSUMVDYELJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dithian-5-ol (CAS 908-35-0), with molecular formula C4H8OS2 and molecular weight 136.00 g/mol. IUPAC: 1,3-dithian-5-ol.
Chemical Property Profile of 1,3-Dithian-5-ol
Property Insights of 1,3-Dithian-5-ol
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dithian-5-ol. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dithian-5-ol. Following Lipinski's Rule of Five, 1,3-Dithian-5-ol has 1 hydrogen bond donor(s) and 3 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 1,3-Dithian-5-ol?
The CAS number of 1,3-Dithian-5-ol is 908-35-0.
What is the molecular formula of 1,3-Dithian-5-ol?
The molecular formula of 1,3-Dithian-5-ol is C4H8OS2.
What is the molecular weight of 1,3-Dithian-5-ol?
The molecular weight of 1,3-Dithian-5-ol is 136.00 g/mol.
Where can I buy 1,3-Dithian-5-ol?
You can request a quote for 1,3-Dithian-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithian-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithian-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.