1,1-乙二硫醇
TL;DR: 1,1-乙二硫醇 (CAS 26914-40-9) is a chemical compound with molecular formula C2H6S2 and molecular weight 93.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-乙二硫醇
ethane-1,1-dithiol
Also Known As: ethane-1,1-dithiol, 1,1-Ethanedithiol, ETHANEDITHIOL, ethandithiol, ethane dithiol
| Molecular Formula | C2H6S2 |
|---|---|
| Molecular Weight | 93.99 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 2.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 93.99109 |
| Heavy Atoms | 4 |
| Complexity | 11.0 |
| Density | 0.829-0.833 |
| Solubility | Soluble in water |
| Refractive Index | 1.369-1.375 |
Chemical Identifiers
| CAS Number | 26914-40-9 |
|---|---|
| SMILES | CC(S)S |
| InChIKey | DHBXNPKRAUYBTH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-乙二硫醇 (CAS 26914-40-9), with molecular formula C2H6S2 and molecular weight 93.99 g/mol. IUPAC: ethane-1,1-dithiol.
Chemical Property Profile of 1,1-乙二硫醇
Property Insights of 1,1-乙二硫醇
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-乙二硫醇. With a topological polar surface area (TPSA) of 2.0 Ų, 1,1-乙二硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-乙二硫醇 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 1,1-乙二硫醇?
The CAS number of 1,1-乙二硫醇 is 26914-40-9.
What is the molecular formula of 1,1-乙二硫醇?
The molecular formula of 1,1-乙二硫醇 is C2H6S2.
What is the molecular weight of 1,1-乙二硫醇?
The molecular weight of 1,1-乙二硫醇 is 93.99 g/mol.
Where can I buy 1,1-乙二硫醇?
You can request a quote for 1,1-乙二硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-乙二硫醇?
Yes, KEHONG BIO provides custom synthesis services for 1,1-乙二硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.