Ethylcyclohexanedithiol
TL;DR: Ethylcyclohexanedithiol (CAS 28679-10-9) is a chemical compound with molecular formula C8H16S2 and molecular weight 176.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethylcyclohexane-1,2-dithiol
Also Known As: Ethylcyclohexanedithiol, 3-ethylcyclohexane-1,2-dithiol, Cyclohexanedithiol,ethyl-, 249-149-5, EINECS 249-149-5
| Molecular Formula | C8H16S2 |
|---|---|
| Molecular Weight | 176.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 2.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.06934 |
| Heavy Atoms | 10 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 28679-10-9 |
|---|---|
| SMILES | CCC1CCCC(C1S)S |
| InChIKey | QOQORWJNWLQESK-UHFFFAOYSA-N |
Product Overview
Ethylcyclohexanedithiol (CAS 28679-10-9), with molecular formula C8H16S2 and molecular weight 176.07 g/mol. IUPAC: 3-ethylcyclohexane-1,2-dithiol.
Chemical Property Profile of Ethylcyclohexanedithiol
Property Insights of Ethylcyclohexanedithiol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethylcyclohexanedithiol. With a topological polar surface area (TPSA) of 2.0 Ų, Ethylcyclohexanedithiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethylcyclohexanedithiol has 2 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 Ethylcyclohexanedithiol?
The CAS number of Ethylcyclohexanedithiol is 28679-10-9.
What is the molecular formula of Ethylcyclohexanedithiol?
The molecular formula of Ethylcyclohexanedithiol is C8H16S2.
What is the molecular weight of Ethylcyclohexanedithiol?
The molecular weight of Ethylcyclohexanedithiol is 176.07 g/mol.
Where can I buy Ethylcyclohexanedithiol?
You can request a quote for Ethylcyclohexanedithiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylcyclohexanedithiol?
Yes, KEHONG BIO provides custom synthesis services for Ethylcyclohexanedithiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.