1,2-苯硫醌
TL;DR: 1,2-苯硫醌 (CAS 17534-15-5) is a chemical compound with molecular formula C6H6S2 and molecular weight 141.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-苯硫醌
benzene-1,2-dithiol
Also Known As: 1,2-Benzenedithiol, Benzene-1,2-dithiol, Benzenedithiol, 1,2-Dimercaptobenzene, Dithiocatechol
| Molecular Formula | C6H6S2 |
|---|---|
| Molecular Weight | 141.99 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 2.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.99109 |
| Heavy Atoms | 8 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 17534-15-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)S)S |
| InChIKey | JRNVQLOKVMWBFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-苯硫醌 (CAS 17534-15-5), with molecular formula C6H6S2 and molecular weight 141.99 g/mol. IUPAC: benzene-1,2-dithiol.
Chemical Property Profile of 1,2-苯硫醌
Property Insights of 1,2-苯硫醌
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-苯硫醌. With a topological polar surface area (TPSA) of 2.0 Ų, 1,2-苯硫醌 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-苯硫醌 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 1,2-苯硫醌?
The CAS number of 1,2-苯硫醌 is 17534-15-5.
What is the molecular formula of 1,2-苯硫醌?
The molecular formula of 1,2-苯硫醌 is C6H6S2.
What is the molecular weight of 1,2-苯硫醌?
The molecular weight of 1,2-苯硫醌 is 141.99 g/mol.
Where can I buy 1,2-苯硫醌?
You can request a quote for 1,2-苯硫醌 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-苯硫醌?
Yes, KEHONG BIO provides custom synthesis services for 1,2-苯硫醌 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.