(S)-alpha-(Trifluoromethyl)benzyl alcohol
TL;DR: (S)-alpha-(Trifluoromethyl)benzyl alcohol (CAS 340-05-6) is a chemical compound with molecular formula C8H7F3O and molecular weight 176.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-1-phenylethanol
Also Known As: 1-Phenyl-2,2,2-trifluoroethanol, 2,2,2-Trifluoro-1-phenylethanol, alpha-(Trifluoromethyl)benzyl alcohol, 2,2,2-trifluoro-1-phenylethan-1-ol, 4-Diphenylmethylpyridine
| Molecular Formula | C8H7F3O |
|---|---|
| Molecular Weight | 176.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.0449 |
| Heavy Atoms | 12 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 340-05-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(F)(F)F)O |
| InChIKey | VNOMEAQPOMDWSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-alpha-(Trifluoromethyl)benzyl alcohol (CAS 340-05-6), with molecular formula C8H7F3O and molecular weight 176.04 g/mol. IUPAC: 2,2,2-trifluoro-1-phenylethanol.
Chemical Property Profile of (S)-alpha-(Trifluoromethyl)benzyl alcohol
Property Insights of (S)-alpha-(Trifluoromethyl)benzyl alcohol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-alpha-(Trifluoromethyl)benzyl alcohol. With a topological polar surface area (TPSA) of 20.2 Ų, (S)-alpha-(Trifluoromethyl)benzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-alpha-(Trifluoromethyl)benzyl alcohol 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
Frequently Asked Questions
What is the CAS number of (S)-alpha-(Trifluoromethyl)benzyl alcohol?
The CAS number of (S)-alpha-(Trifluoromethyl)benzyl alcohol is 340-05-6.
What is the molecular formula of (S)-alpha-(Trifluoromethyl)benzyl alcohol?
The molecular formula of (S)-alpha-(Trifluoromethyl)benzyl alcohol is C8H7F3O.
What is the molecular weight of (S)-alpha-(Trifluoromethyl)benzyl alcohol?
The molecular weight of (S)-alpha-(Trifluoromethyl)benzyl alcohol is 176.04 g/mol.
Where can I buy (S)-alpha-(Trifluoromethyl)benzyl alcohol?
You can request a quote for (S)-alpha-(Trifluoromethyl)benzyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-alpha-(Trifluoromethyl)benzyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for (S)-alpha-(Trifluoromethyl)benzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.