1,1-环己二硫醇
TL;DR: 1,1-环己二硫醇 (CAS 3855-24-1) is a chemical compound with molecular formula C6H12S2 and molecular weight 148.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-环己二硫醇
cyclohexane-1,1-dithiol
Also Known As: Cyclohexane-1,1-dithiol, 1,1-Cyclohexanedithiol, 1,1-dimercaptocyclohexane, Bisthionaphthenfarbstoffe, Cyclohexan-1,1-dithiol
| Molecular Formula | C6H12S2 |
|---|---|
| Molecular Weight | 148.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 2.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.03804 |
| Heavy Atoms | 8 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 3855-24-1 |
|---|---|
| SMILES | C1CCC(CC1)(S)S |
| InChIKey | VSARMWHOISBCGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-环己二硫醇 (CAS 3855-24-1), with molecular formula C6H12S2 and molecular weight 148.04 g/mol. IUPAC: cyclohexane-1,1-dithiol.
Chemical Property Profile of 1,1-环己二硫醇
Property Insights of 1,1-环己二硫醇
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-环己二硫醇. With a topological polar surface area (TPSA) of 2.0 Ų, 1,1-环己二硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-环己二硫醇 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-环己二硫醇?
The CAS number of 1,1-环己二硫醇 is 3855-24-1.
What is the molecular formula of 1,1-环己二硫醇?
The molecular formula of 1,1-环己二硫醇 is C6H12S2.
What is the molecular weight of 1,1-环己二硫醇?
The molecular weight of 1,1-环己二硫醇 is 148.04 g/mol.
Where can I buy 1,1-环己二硫醇?
You can request a quote for 1,1-环己二硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-环己二硫醇?
Yes, KEHONG BIO provides custom synthesis services for 1,1-环己二硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.