2-(Trifluoromethylthio)benzyl alcohol
TL;DR: 2-(Trifluoromethylthio)benzyl alcohol (CAS 239463-93-5) is a chemical compound with molecular formula C8H7F3OS and molecular weight 208.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(trifluoromethylsulfanyl)phenyl]methanol
Also Known As: 2-(Trifluoromethylthio)benzyl alcohol, [2-(trifluoromethylsulfanyl)phenyl]methanol, RARECHEM AL BD 0452, {2-[(trifluoromethyl)sulfanyl]phenyl}methanol, 2-(Triofluoromethylthio)Benzyl Alcohol
| Molecular Formula | C8H7F3OS |
|---|---|
| Molecular Weight | 208.02 g/mol |
| LogP | 2.7908 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.01697 |
| Heavy Atoms | 13 |
| Complexity | 284.96277 |
Chemical Identifiers
| CAS Number | 239463-93-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CO)SC(F)(F)F |
Product Overview
2-(Trifluoromethylthio)benzyl alcohol (CAS 239463-93-5), with molecular formula C8H7F3OS and molecular weight 208.02 g/mol. IUPAC: [2-(trifluoromethylsulfanyl)phenyl]methanol.
Chemical Property Profile of 2-(Trifluoromethylthio)benzyl alcohol
Property Insights of 2-(Trifluoromethylthio)benzyl alcohol
The XLogP value of 2.7908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Trifluoromethylthio)benzyl alcohol. With a topological polar surface area (TPSA) of 20.23 Ų, 2-(Trifluoromethylthio)benzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Trifluoromethylthio)benzyl alcohol 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-(Trifluoromethylthio)benzyl alcohol?
The CAS number of 2-(Trifluoromethylthio)benzyl alcohol is 239463-93-5.
What is the molecular formula of 2-(Trifluoromethylthio)benzyl alcohol?
The molecular formula of 2-(Trifluoromethylthio)benzyl alcohol is C8H7F3OS.
What is the molecular weight of 2-(Trifluoromethylthio)benzyl alcohol?
The molecular weight of 2-(Trifluoromethylthio)benzyl alcohol is 208.02 g/mol.
Where can I buy 2-(Trifluoromethylthio)benzyl alcohol?
You can request a quote for 2-(Trifluoromethylthio)benzyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Trifluoromethylthio)benzyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Trifluoromethylthio)benzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.