4,4'-Dithiobisbutan-1-ol
TL;DR: 4,4'-Dithiobisbutan-1-ol (CAS 30453-20-4) is a chemical compound with molecular formula C8H18O2S2 and molecular weight 210.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxybutyldisulfanyl)butan-1-ol
Also Known As: 4,4'-Dithiobisbutan-1-ol, 1-butanol, 4,4'-dithiobis-, 4,4'-Dithiobis[1-butanol], 4,4'-dithiodibutan-1-ol, 4-(4-hydroxybutyldisulfanyl)butan-1-ol
| Molecular Formula | C8H18O2S2 |
|---|---|
| Molecular Weight | 210.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 210.07483 |
| Heavy Atoms | 12 |
| Complexity | 71.0 |
Chemical Identifiers
| CAS Number | 30453-20-4 |
|---|---|
| SMILES | C(CCSSCCCCO)CO |
| InChIKey | RUCLWVAQWOEEPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Dithiobisbutan-1-ol (CAS 30453-20-4), with molecular formula C8H18O2S2 and molecular weight 210.07 g/mol. IUPAC: 4-(4-hydroxybutyldisulfanyl)butan-1-ol.
Chemical Property Profile of 4,4'-Dithiobisbutan-1-ol
Property Insights of 4,4'-Dithiobisbutan-1-ol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-Dithiobisbutan-1-ol. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-Dithiobisbutan-1-ol. Following Lipinski's Rule of Five, 4,4'-Dithiobisbutan-1-ol has 2 hydrogen bond donor(s) and 4 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 4,4'-Dithiobisbutan-1-ol?
The CAS number of 4,4'-Dithiobisbutan-1-ol is 30453-20-4.
What is the molecular formula of 4,4'-Dithiobisbutan-1-ol?
The molecular formula of 4,4'-Dithiobisbutan-1-ol is C8H18O2S2.
What is the molecular weight of 4,4'-Dithiobisbutan-1-ol?
The molecular weight of 4,4'-Dithiobisbutan-1-ol is 210.07 g/mol.
Where can I buy 4,4'-Dithiobisbutan-1-ol?
You can request a quote for 4,4'-Dithiobisbutan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Dithiobisbutan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Dithiobisbutan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.