![1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone structure](/static/products/6363/63639-61-2.webp)
1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone
TL;DR: 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone (CAS 63639-61-2) is a chemical compound with molecular formula C8H6F3NO2 and molecular weight 205.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-2-(trifluoromethyl)-1H-pyridin-4-one
Also Known As: 1-[4-HYDROXY-2-(TRIFLUOROMETHYL)PYRIDIN-3-YL]-ETHANONE, 6263AD, 3-acetyl-2-(trifluoromethyl)-1H-pyridin-4-one, 1-[4-hydroxy-2-(trifluoromethyl)pyridin-3-yl]ethanone, 2-(Trifluoromethyl)-3-acetylpyridin-4-ol
| Molecular Formula | C8H6F3NO2 |
|---|---|
| Molecular Weight | 205.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.03506 |
| Heavy Atoms | 14 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 63639-61-2 |
|---|---|
| SMILES | CC(=O)C1=C(NC=CC1=O)C(F)(F)F |
| InChIKey | URVYIANWVKDPOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone (CAS 63639-61-2), with molecular formula C8H6F3NO2 and molecular weight 205.04 g/mol. IUPAC: 3-acetyl-2-(trifluoromethyl)-1H-pyridin-4-one.
Chemical Property Profile of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone
Property Insights of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone. With a topological polar surface area (TPSA) of 46.2 Ų, 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone has 1 hydrogen bond donor(s) and 6 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 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone?
The CAS number of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone is 63639-61-2.
What is the molecular formula of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone?
The molecular formula of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone is C8H6F3NO2.
What is the molecular weight of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone?
The molecular weight of 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone is 205.04 g/mol.
Where can I buy 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone?
You can request a quote for 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-Hydroxy-2-(trifluoromethyl)pyridin-3-YL]-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.