![2-[3-(Trifluoromethyl)phenyl]sulfonylethanol structure](/static/products/5487/548739-95-3.webp)
2-[3-(Trifluoromethyl)phenyl]sulfonylethanol
TL;DR: 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol (CAS 548739-95-3) is a chemical compound with molecular formula C9H9F3O3S and molecular weight 254.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(trifluoromethyl)phenyl]sulfonylethanol
Also Known As: 3-Trifluoromethylphenylsulfonylethanol, 2-[3-(trifluoromethyl)phenyl]sulfonylethanol, 2-{[3-(Trifluoromethyl)phenyl]sulfonyl}ethanol, 2-[3-(trifluoromethyl)benzenesulfonyl]ethan-1-ol, 2-[3-(TRIFLUOROMETHYL)BENZENESULFONYL]ETHANOL
| Molecular Formula | C9H9F3O3S |
|---|---|
| Molecular Weight | 254.02 g/mol |
| LogP | 1.4714 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.02245 |
| Heavy Atoms | 16 |
| Complexity | 465.13272 |
Chemical Identifiers
| CAS Number | 548739-95-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)CCO)C(F)(F)F |
Product Overview
2-[3-(Trifluoromethyl)phenyl]sulfonylethanol (CAS 548739-95-3), with molecular formula C9H9F3O3S and molecular weight 254.02 g/mol. IUPAC: 2-[3-(trifluoromethyl)phenyl]sulfonylethanol.
Chemical Property Profile of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol
Property Insights of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol
The XLogP value of 1.4714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol. With a topological polar surface area (TPSA) of 54.37 Ų, 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol has 1 hydrogen bond donor(s) and 3 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-(Trifluoromethyl)phenyl]sulfonylethanol?
The CAS number of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol is 548739-95-3.
What is the molecular formula of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol?
The molecular formula of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol is C9H9F3O3S.
What is the molecular weight of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol?
The molecular weight of 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol is 254.02 g/mol.
Where can I buy 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol?
You can request a quote for 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(Trifluoromethyl)phenyl]sulfonylethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.