2,6-二氯苯硫酚
TL;DR: 2,6-二氯苯硫酚 (CAS 24966-39-0) is a chemical compound with molecular formula C6H4Cl2S and molecular weight 177.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-二氯苯硫酚
2,6-dichlorobenzenethiol
Also Known As: 2,6-Dichlorobenzenethiol, 2,6-Dichlorothiophenol, Benzenethiol, 2,6-dichloro-, 2,6-Dichloro thiophenol, 2,6-dichlorobenzene-1-thiol
| Molecular Formula | C6H4Cl2S |
|---|---|
| Molecular Weight | 177.94 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.94107 |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 24966-39-0 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)S)Cl |
| InChIKey | JBISHCXLCGVPGW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-二氯苯硫酚 (CAS 24966-39-0), with molecular formula C6H4Cl2S and molecular weight 177.94 g/mol. IUPAC: 2,6-dichlorobenzenethiol.
Chemical Property Profile of 2,6-二氯苯硫酚
Property Insights of 2,6-二氯苯硫酚
The XLogP value of 3.3 indicates that 2,6-二氯苯硫酚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, 2,6-二氯苯硫酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-二氯苯硫酚 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 2,6-二氯苯硫酚?
The CAS number of 2,6-二氯苯硫酚 is 24966-39-0.
What is the molecular formula of 2,6-二氯苯硫酚?
The molecular formula of 2,6-二氯苯硫酚 is C6H4Cl2S.
What is the molecular weight of 2,6-二氯苯硫酚?
The molecular weight of 2,6-二氯苯硫酚 is 177.94 g/mol.
Where can I buy 2,6-二氯苯硫酚?
You can request a quote for 2,6-二氯苯硫酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-二氯苯硫酚?
Yes, KEHONG BIO provides custom synthesis services for 2,6-二氯苯硫酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.