Ethyl methyl trisulfide
TL;DR: Ethyl methyl trisulfide (CAS 31499-71-5) is a chemical compound with molecular formula C3H8S3 and molecular weight 139.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(methyltrisulfanyl)ethane
Also Known As: Methyl ethyl trisulfide, ethyl methyl trisulfide, (methyltrisulfanyl)ethane, Trisulfide, ethyl methyl, 2,3,4-trithiahexane
| Molecular Formula | C3H8S3 |
|---|---|
| Molecular Weight | 139.98 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 139.97882 |
| Heavy Atoms | 6 |
| Complexity | 22.0 |
Chemical Identifiers
| CAS Number | 31499-71-5 |
|---|---|
| SMILES | CCSSSC |
| InChIKey | XEKUTWIJPKGAQT-UHFFFAOYSA-N |
Product Overview
Ethyl methyl trisulfide (CAS 31499-71-5), with molecular formula C3H8S3 and molecular weight 139.98 g/mol. IUPAC: (methyltrisulfanyl)ethane.
Chemical Property Profile of Ethyl methyl trisulfide
Property Insights of Ethyl methyl trisulfide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl methyl trisulfide. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl methyl trisulfide. Following Lipinski's Rule of Five, Ethyl methyl trisulfide has 0 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 Ethyl methyl trisulfide?
The CAS number of Ethyl methyl trisulfide is 31499-71-5.
What is the molecular formula of Ethyl methyl trisulfide?
The molecular formula of Ethyl methyl trisulfide is C3H8S3.
What is the molecular weight of Ethyl methyl trisulfide?
The molecular weight of Ethyl methyl trisulfide is 139.98 g/mol.
Where can I buy Ethyl methyl trisulfide?
You can request a quote for Ethyl methyl trisulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl methyl trisulfide?
Yes, KEHONG BIO provides custom synthesis services for Ethyl methyl trisulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.