2-((2-Phenylethyl)thio)ethanol
TL;DR: 2-((2-Phenylethyl)thio)ethanol (CAS 3778-82-3) is a chemical compound with molecular formula C10H14OS and molecular weight 182.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenylethylsulfanyl)ethanol
Also Known As: 2- ethanol, 2-(Phenethylthio)ethanol, phenethylthio-2 ethanol, ETHANOL, 2-(PHENETHYLTHIO)-, 2-phenethylsulfanylethanol
| Molecular Formula | C10H14OS |
|---|---|
| Molecular Weight | 182.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 182.07654 |
| Heavy Atoms | 12 |
| Complexity | 100.0 |
Chemical Identifiers
| CAS Number | 3778-82-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCSCCO |
| InChIKey | KGZHEXGRHGYQNI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((2-Phenylethyl)thio)ethanol (CAS 3778-82-3), with molecular formula C10H14OS and molecular weight 182.08 g/mol. IUPAC: 2-(2-phenylethylsulfanyl)ethanol.
Chemical Property Profile of 2-((2-Phenylethyl)thio)ethanol
Property Insights of 2-((2-Phenylethyl)thio)ethanol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2-Phenylethyl)thio)ethanol. With a topological polar surface area (TPSA) of 45.5 Ų, 2-((2-Phenylethyl)thio)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2-Phenylethyl)thio)ethanol 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-((2-Phenylethyl)thio)ethanol?
The CAS number of 2-((2-Phenylethyl)thio)ethanol is 3778-82-3.
What is the molecular formula of 2-((2-Phenylethyl)thio)ethanol?
The molecular formula of 2-((2-Phenylethyl)thio)ethanol is C10H14OS.
What is the molecular weight of 2-((2-Phenylethyl)thio)ethanol?
The molecular weight of 2-((2-Phenylethyl)thio)ethanol is 182.08 g/mol.
Where can I buy 2-((2-Phenylethyl)thio)ethanol?
You can request a quote for 2-((2-Phenylethyl)thio)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Phenylethyl)thio)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Phenylethyl)thio)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.