2,3,5,6-Tetrachlorobenzene-1-thiol
TL;DR: 2,3,5,6-Tetrachlorobenzene-1-thiol (CAS 4707-16-8) is a chemical compound with molecular formula C6H2Cl4S and molecular weight 245.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetrachlorobenzenethiol
Also Known As: 2,3,5,6-tetrachlorobenzenethiol, 2,3,5,6-tetrachlorobenzene-1-thiol, 2,3,5,6-Tetrachlorothiophenol, Benzenethiol, 2,3,5,6-tetrachloro-, Benzenethiol,2,3,5,6-tetrachloro-
| Molecular Formula | C6H2Cl4S |
|---|---|
| Molecular Weight | 245.86 g/mol |
| LogP | 4.5889 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.86313 |
| Heavy Atoms | 11 |
| Complexity | 270.87402 |
Chemical Identifiers
| CAS Number | 4707-16-8 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Cl)Cl)S)Cl)Cl |
Product Overview
2,3,5,6-Tetrachlorobenzene-1-thiol (CAS 4707-16-8), with molecular formula C6H2Cl4S and molecular weight 245.86 g/mol. IUPAC: 2,3,5,6-tetrachlorobenzenethiol.
Chemical Property Profile of 2,3,5,6-Tetrachlorobenzene-1-thiol
Property Insights of 2,3,5,6-Tetrachlorobenzene-1-thiol
The XLogP value of 4.5889 indicates that 2,3,5,6-Tetrachlorobenzene-1-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3,5,6-Tetrachlorobenzene-1-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6-Tetrachlorobenzene-1-thiol has 1 hydrogen bond donor(s) and 1 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 2,3,5,6-Tetrachlorobenzene-1-thiol?
The CAS number of 2,3,5,6-Tetrachlorobenzene-1-thiol is 4707-16-8.
What is the molecular formula of 2,3,5,6-Tetrachlorobenzene-1-thiol?
The molecular formula of 2,3,5,6-Tetrachlorobenzene-1-thiol is C6H2Cl4S.
What is the molecular weight of 2,3,5,6-Tetrachlorobenzene-1-thiol?
The molecular weight of 2,3,5,6-Tetrachlorobenzene-1-thiol is 245.86 g/mol.
Where can I buy 2,3,5,6-Tetrachlorobenzene-1-thiol?
You can request a quote for 2,3,5,6-Tetrachlorobenzene-1-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6-Tetrachlorobenzene-1-thiol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6-Tetrachlorobenzene-1-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.