Methyl 1-(methylthio)propyl disulfide
TL;DR: Methyl 1-(methylthio)propyl disulfide (CAS 53897-66-8) is a chemical compound with molecular formula C5H12S3 and molecular weight 168.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(methyldisulfanyl)-1-methylsulfanylpropane
Also Known As: Methyl 1-(methylthio)propyl disulfide, 4-ethyl-2,3,5-trithiahexane, 3-Ethyl-2,4,5-trithiahexane, Disulfide, methyl 1-(methylthio)propyl, 1-(Methylthiopropyl) methyl disulfide
| Molecular Formula | C5H12S3 |
|---|---|
| Molecular Weight | 168.01 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.01012 |
| Heavy Atoms | 8 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 53897-66-8 |
|---|---|
| SMILES | CCC(SC)SSC |
| InChIKey | OGKCJWOOFUPRSV-UHFFFAOYSA-N |
Product Overview
Methyl 1-(methylthio)propyl disulfide (CAS 53897-66-8), with molecular formula C5H12S3 and molecular weight 168.01 g/mol. IUPAC: 1-(methyldisulfanyl)-1-methylsulfanylpropane.
Chemical Property Profile of Methyl 1-(methylthio)propyl disulfide
Property Insights of Methyl 1-(methylthio)propyl disulfide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-(methylthio)propyl disulfide. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-(methylthio)propyl disulfide. Following Lipinski's Rule of Five, Methyl 1-(methylthio)propyl disulfide 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 Methyl 1-(methylthio)propyl disulfide?
The CAS number of Methyl 1-(methylthio)propyl disulfide is 53897-66-8.
What is the molecular formula of Methyl 1-(methylthio)propyl disulfide?
The molecular formula of Methyl 1-(methylthio)propyl disulfide is C5H12S3.
What is the molecular weight of Methyl 1-(methylthio)propyl disulfide?
The molecular weight of Methyl 1-(methylthio)propyl disulfide is 168.01 g/mol.
Where can I buy Methyl 1-(methylthio)propyl disulfide?
You can request a quote for Methyl 1-(methylthio)propyl disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-(methylthio)propyl disulfide?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-(methylthio)propyl disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.