4,9-Dithiadodecane
TL;DR: 4,9-Dithiadodecane (CAS 5675-22-9) is a chemical compound with molecular formula C10H22S2 and molecular weight 206.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(propylsulfanyl)butane
Also Known As: 4,9-dithiadodecane, 1,4-bis(propylthio)butane, 1,4-bis(propylsulfanyl)butane, 1,4-Bis-propylsulfanyl-butane, Butane, 1,4-bis(propylthio)-
| Molecular Formula | C10H22S2 |
|---|---|
| Molecular Weight | 206.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 206.11629 |
| Heavy Atoms | 12 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 5675-22-9 |
|---|---|
| SMILES | CCCSCCCCSCCC |
| InChIKey | NKVHHVXGFXBRPN-UHFFFAOYSA-N |
Product Overview
4,9-Dithiadodecane (CAS 5675-22-9), with molecular formula C10H22S2 and molecular weight 206.12 g/mol. IUPAC: 1,4-bis(propylsulfanyl)butane.
Chemical Property Profile of 4,9-Dithiadodecane
Property Insights of 4,9-Dithiadodecane
The XLogP value of 4.0 indicates that 4,9-Dithiadodecane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 4,9-Dithiadodecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,9-Dithiadodecane has 0 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 4,9-Dithiadodecane?
The CAS number of 4,9-Dithiadodecane is 5675-22-9.
What is the molecular formula of 4,9-Dithiadodecane?
The molecular formula of 4,9-Dithiadodecane is C10H22S2.
What is the molecular weight of 4,9-Dithiadodecane?
The molecular weight of 4,9-Dithiadodecane is 206.12 g/mol.
Where can I buy 4,9-Dithiadodecane?
You can request a quote for 4,9-Dithiadodecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,9-Dithiadodecane?
Yes, KEHONG BIO provides custom synthesis services for 4,9-Dithiadodecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.