4'-Hydroxy-2'-(trifluoromethyl)acetophenone
TL;DR: 4'-Hydroxy-2'-(trifluoromethyl)acetophenone (CAS 220227-53-2) is a chemical compound with molecular formula C9H7F3O2 and molecular weight 204.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-hydroxy-2-(trifluoromethyl)phenyl]ethanone
Also Known As: 1-(4-Hydroxy-2-(trifluoromethyl)phenyl)ethanone, 1-[4-hydroxy-2-(trifluoromethyl)phenyl]ethanone, 4'-Hydroxy-2'-trifluoromethylacetophenone, 4'-Hydroxy-2'-(trifluoromethyl)acetophenone, EthylStilbene-4-carboxylate
| Molecular Formula | C9H7F3O2 |
|---|---|
| Molecular Weight | 204.04 g/mol |
| LogP | 2.6136 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.03981 |
| Heavy Atoms | 14 |
| Complexity | 368.8101 |
Chemical Identifiers
| CAS Number | 220227-53-2 |
|---|---|
| SMILES | CC(=O)C1=C(C=C(C=C1)O)C(F)(F)F |
Product Overview
4'-Hydroxy-2'-(trifluoromethyl)acetophenone (CAS 220227-53-2), with molecular formula C9H7F3O2 and molecular weight 204.04 g/mol. IUPAC: 1-[4-hydroxy-2-(trifluoromethyl)phenyl]ethanone.
Chemical Property Profile of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone
Property Insights of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone
The XLogP value of 2.6136 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Hydroxy-2'-(trifluoromethyl)acetophenone. With a topological polar surface area (TPSA) of 37.3 Ų, 4'-Hydroxy-2'-(trifluoromethyl)acetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Hydroxy-2'-(trifluoromethyl)acetophenone has 1 hydrogen bond donor(s) and 2 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 4'-Hydroxy-2'-(trifluoromethyl)acetophenone?
The CAS number of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone is 220227-53-2.
What is the molecular formula of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone?
The molecular formula of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone is C9H7F3O2.
What is the molecular weight of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone?
The molecular weight of 4'-Hydroxy-2'-(trifluoromethyl)acetophenone is 204.04 g/mol.
Where can I buy 4'-Hydroxy-2'-(trifluoromethyl)acetophenone?
You can request a quote for 4'-Hydroxy-2'-(trifluoromethyl)acetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Hydroxy-2'-(trifluoromethyl)acetophenone?
Yes, KEHONG BIO provides custom synthesis services for 4'-Hydroxy-2'-(trifluoromethyl)acetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.