2,6-Dichlorophenylthioethanol
TL;DR: 2,6-Dichlorophenylthioethanol (CAS 688762-66-5) is a chemical compound with molecular formula C8H8Cl2OS and molecular weight 221.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,6-dichlorophenyl)sulfanylethanol
Also Known As: 2,6-Dichlorophenylthioethanol, 2-(2,6-dichlorophenyl)sulfanylethanol, 2-(2,6-dichlorophenylthio)ethan-1-ol, 2-[(2,6-dichlorophenyl)sulfanyl]ethan-1-ol
| Molecular Formula | C8H8Cl2OS |
|---|---|
| Molecular Weight | 221.97 g/mol |
| LogP | 3.0778 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.96729 |
| Heavy Atoms | 12 |
| Complexity | 244.98482 |
Chemical Identifiers
| CAS Number | 688762-66-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)SCCO)Cl |
Product Overview
2,6-Dichlorophenylthioethanol (CAS 688762-66-5), with molecular formula C8H8Cl2OS and molecular weight 221.97 g/mol. IUPAC: 2-(2,6-dichlorophenyl)sulfanylethanol.
Chemical Property Profile of 2,6-Dichlorophenylthioethanol
Property Insights of 2,6-Dichlorophenylthioethanol
The XLogP value of 3.0778 indicates that 2,6-Dichlorophenylthioethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 2,6-Dichlorophenylthioethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichlorophenylthioethanol has 1 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 2,6-Dichlorophenylthioethanol?
The CAS number of 2,6-Dichlorophenylthioethanol is 688762-66-5.
What is the molecular formula of 2,6-Dichlorophenylthioethanol?
The molecular formula of 2,6-Dichlorophenylthioethanol is C8H8Cl2OS.
What is the molecular weight of 2,6-Dichlorophenylthioethanol?
The molecular weight of 2,6-Dichlorophenylthioethanol is 221.97 g/mol.
Where can I buy 2,6-Dichlorophenylthioethanol?
You can request a quote for 2,6-Dichlorophenylthioethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dichlorophenylthioethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dichlorophenylthioethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.