Diallyl Tetrasulfide
TL;DR: Diallyl Tetrasulfide (CAS 2444-49-7) is a chemical compound with molecular formula C6H10S4 and molecular weight 209.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(prop-2-enyltetrasulfanyl)prop-1-ene
Also Known As: Diallyl tetrasulfide, Diallyl tetrasulphide, Diallyltetrasulfide, Dially tetrasulfide, allyl tetrasulfide
| Molecular Formula | C6H10S4 |
|---|---|
| Molecular Weight | 209.97 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 209.96654 |
| Heavy Atoms | 10 |
| Complexity | 79.0 |
| Boiling Point | 279.00 to 280.00 °C. @ 760.00 mm Hg |
Chemical Identifiers
| CAS Number | 2444-49-7 |
|---|---|
| SMILES | C=CCSSSSCC=C |
| InChIKey | RMKCQUWJDRTEHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diallyl Tetrasulfide (CAS 2444-49-7), with molecular formula C6H10S4 and molecular weight 209.97 g/mol. IUPAC: 3-(prop-2-enyltetrasulfanyl)prop-1-ene.
Chemical Property Profile of Diallyl Tetrasulfide
Property Insights of Diallyl Tetrasulfide
The XLogP value of 3.1 indicates that Diallyl Tetrasulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diallyl Tetrasulfide. Following Lipinski's Rule of Five, Diallyl Tetrasulfide has 0 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 Diallyl Tetrasulfide?
The CAS number of Diallyl Tetrasulfide is 2444-49-7.
What is the molecular formula of Diallyl Tetrasulfide?
The molecular formula of Diallyl Tetrasulfide is C6H10S4.
What is the molecular weight of Diallyl Tetrasulfide?
The molecular weight of Diallyl Tetrasulfide is 209.97 g/mol.
Where can I buy Diallyl Tetrasulfide?
You can request a quote for Diallyl Tetrasulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diallyl Tetrasulfide?
Yes, KEHONG BIO provides custom synthesis services for Diallyl Tetrasulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.