(1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol
TL;DR: (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol (CAS 1568164-40-8) is a chemical compound with molecular formula C10H11F3O and molecular weight 204.0762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethanol
Also Known As: (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol, (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethanol
Technical Specifications
| Molecular Formula | C10H11F3O |
| Molecular Weight | 204.0762 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.0762 Da |
| Heavy Atoms | 14 |
| Complexity | 190.0 |
| SMILES | CC1=CC(=C(C=C1)C)[C@@H](C(F)(F)F)O |
| InChIKey | SCYMTVOTDWIOSX-VIFPVBQESA-N |
Chemical Property Profile of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol
Property Insights of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-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)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol?
The CAS number of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol is 1568164-40-8.
What is the molecular formula of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol?
The molecular formula of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol is C10H11F3O.
What is the molecular weight of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol?
The molecular weight of (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol is 204.0762 g/mol.
Where can I buy (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol?
You can request a quote for (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol?
Yes, CoreyChem provides custom synthesis services for (1S)-1-(2,5-dimethylphenyl)-2,2,2-trifluoroethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.