Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-
TL;DR: Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- (CAS 321-37-9) is a chemical compound with molecular formula C8H4ClF3O and molecular weight 207.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2,2,2-trifluoroethanone
Also Known As: 1-(4-chlorophenyl)-2,2,2-trifluoroethanone, 4'-Chloro-2,2,2-trifluoroacetophenone, 1-(4-chlorophenyl)-2,2,2-trifluoroethan-1-one, 2,2,2-Trifluoro-4'-chloroacetophenone, Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-
| Molecular Formula | C8H4ClF3O |
|---|---|
| Molecular Weight | 207.99 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.99028 |
| Heavy Atoms | 13 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 321-37-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C(F)(F)F)Cl |
| InChIKey | DYPQUENOGZXOGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- (CAS 321-37-9), with molecular formula C8H4ClF3O and molecular weight 207.99 g/mol. IUPAC: 1-(4-chlorophenyl)-2,2,2-trifluoroethanone.
Chemical Property Profile of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-
Property Insights of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-. With a topological polar surface area (TPSA) of 17.1 Ų, Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- has 0 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 Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-?
The CAS number of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- is 321-37-9.
What is the molecular formula of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-?
The molecular formula of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- is C8H4ClF3O.
What is the molecular weight of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-?
The molecular weight of Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- is 207.99 g/mol.
Where can I buy Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-?
You can request a quote for Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-chlorophenyl)-2,2,2-trifluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.