(1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol
TL;DR: (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol (CAS 1567941-84-7) is a chemical compound with molecular formula C9H9F3O and molecular weight 190.06055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethanol
Also Known As: (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol, J1.195.337I, (S)-2,2,2-Trifluoro-1-(2-methylphenyl)ethanol
Technical Specifications
| Molecular Formula | C9H9F3O |
| Molecular Weight | 190.06055 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.06055 Da |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
| SMILES | CC1=CC=CC=C1[C@@H](C(F)(F)F)O |
| InChIKey | SXMWJABIUDHACE-QMMMGPOBSA-N |
Chemical Property Profile of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol
Property Insights of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol?
The CAS number of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol is 1567941-84-7.
What is the molecular formula of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol?
The molecular formula of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol is C9H9F3O.
What is the molecular weight of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol?
The molecular weight of (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol is 190.06055 g/mol.
Where can I buy (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol?
You can request a quote for (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol?
Yes, CoreyChem provides custom synthesis services for (1S)-2,2,2-trifluoro-1-(2-methylphenyl)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.