(s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol
TL;DR: (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol (CAS 80446-60-2) is a chemical compound with molecular formula C9H9F3O and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-2,2,2-trifluoro-1-(4-methylphenyl)ethanol
Also Known As: (s)-2,2,2-trifluoro-1-(p-tolyl)ethanol, (1S)-2,2,2-trifluoro-1-(4-methylphenyl)ethan-1-ol, (1S)-2,2,2-trifluoro-1-(4-methylphenyl)ethanol
| Molecular Formula | C9H9F3O |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 2.59072 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.06055 |
| Heavy Atoms | 13 |
| Complexity | 275.90643 |
Chemical Identifiers
| CAS Number | 80446-60-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)[C@@H](C(F)(F)F)O |
Product Overview
(s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol (CAS 80446-60-2), with molecular formula C9H9F3O and molecular weight 190.06 g/mol. IUPAC: (1S)-2,2,2-trifluoro-1-(4-methylphenyl)ethanol.
Chemical Property Profile of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol
Property Insights of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol
The XLogP value of 2.59072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol. With a topological polar surface area (TPSA) of 20.23 Ų, (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol 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 (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol?
The CAS number of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol is 80446-60-2.
What is the molecular formula of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol?
The molecular formula of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol is C9H9F3O.
What is the molecular weight of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol?
The molecular weight of (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol is 190.06 g/mol.
Where can I buy (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol?
You can request a quote for (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for (s)-2,2,2-Trifluoro-1-(p-tolyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.