Ethyl isobutyl disulfide
TL;DR: Ethyl isobutyl disulfide (CAS 40136-66-1) is a chemical compound with molecular formula C6H14S2 and molecular weight 150.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(ethyldisulfanyl)-2-methylpropane
Also Known As: Ethyl isobutyl disulfide, ethyl-isobutyl-disulfane, Isobutyl ethyl disulfide, Ethylisobutyl persulfide, Disulfide, ethyl isobutyl
| Molecular Formula | C6H14S2 |
|---|---|
| Molecular Weight | 150.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 150.0537 |
| Heavy Atoms | 8 |
| Complexity | 43.0 |
Chemical Identifiers
| CAS Number | 40136-66-1 |
|---|---|
| SMILES | CCSSCC(C)C |
| InChIKey | UMASWDYQHOTZKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl isobutyl disulfide (CAS 40136-66-1), with molecular formula C6H14S2 and molecular weight 150.05 g/mol. IUPAC: 1-(ethyldisulfanyl)-2-methylpropane.
Chemical Property Profile of Ethyl isobutyl disulfide
Property Insights of Ethyl isobutyl disulfide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl isobutyl disulfide. With a topological polar surface area (TPSA) of 50.6 Ų, Ethyl isobutyl disulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl isobutyl disulfide 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 Ethyl isobutyl disulfide?
The CAS number of Ethyl isobutyl disulfide is 40136-66-1.
What is the molecular formula of Ethyl isobutyl disulfide?
The molecular formula of Ethyl isobutyl disulfide is C6H14S2.
What is the molecular weight of Ethyl isobutyl disulfide?
The molecular weight of Ethyl isobutyl disulfide is 150.05 g/mol.
Where can I buy Ethyl isobutyl disulfide?
You can request a quote for Ethyl isobutyl disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl isobutyl disulfide?
Yes, KEHONG BIO provides custom synthesis services for Ethyl isobutyl disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.