1,5-Dithiacyclooctan-3-ol
TL;DR: 1,5-Dithiacyclooctan-3-ol (CAS 86944-00-5) is a chemical compound with molecular formula C6H12OS2 and molecular weight 164.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dithiocan-3-ol
Also Known As: 1,5-Dithiacyclooctan-3-ol, 1,5-Dithiocan-3-ol, 1,5-dithiacyclooctane-3-ol, 3-hydroxy-1,5-dithiacyclooctane, 1,5-Dithiacyclooctan-3-ol technical
| Molecular Formula | C6H12OS2 |
|---|---|
| Molecular Weight | 164.03 g/mol |
| LogP | 1.2174 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.03296 |
| Heavy Atoms | 9 |
| Complexity | 69.458115 |
Chemical Identifiers
| CAS Number | 86944-00-5 |
|---|---|
| SMILES | C1CSCC(CSC1)O |
Product Overview
1,5-Dithiacyclooctan-3-ol (CAS 86944-00-5), with molecular formula C6H12OS2 and molecular weight 164.03 g/mol. IUPAC: 1,5-dithiocan-3-ol.
Chemical Property Profile of 1,5-Dithiacyclooctan-3-ol
Property Insights of 1,5-Dithiacyclooctan-3-ol
The XLogP value of 1.2174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Dithiacyclooctan-3-ol. With a topological polar surface area (TPSA) of 20.23 Ų, 1,5-Dithiacyclooctan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dithiacyclooctan-3-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 1,5-Dithiacyclooctan-3-ol?
The CAS number of 1,5-Dithiacyclooctan-3-ol is 86944-00-5.
What is the molecular formula of 1,5-Dithiacyclooctan-3-ol?
The molecular formula of 1,5-Dithiacyclooctan-3-ol is C6H12OS2.
What is the molecular weight of 1,5-Dithiacyclooctan-3-ol?
The molecular weight of 1,5-Dithiacyclooctan-3-ol is 164.03 g/mol.
Where can I buy 1,5-Dithiacyclooctan-3-ol?
You can request a quote for 1,5-Dithiacyclooctan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dithiacyclooctan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dithiacyclooctan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.