3',4'-Dichloro-2,2,2-trifluoroacetophenone
TL;DR: 3',4'-Dichloro-2,2,2-trifluoroacetophenone (CAS 125733-43-9) is a chemical compound with molecular formula C8H3Cl2F3O and molecular weight 241.95131 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dichlorophenyl)-2,2,2-trifluoroethanone
Also Known As: 3',4'-Dichloro-2,2,2-trifluoroacetophenone, 1-(3,4-dichlorophenyl)-2,2,2-trifluoroethanone, 1-(3,4-dichlorophenyl)-2,2,2-trifluoroethan-1-one, 4856AA, Ethanone, 1-(3,4-dichlorophenyl)-2,2,2-trifluoro-
Technical Specifications
| Molecular Formula | C8H3Cl2F3O |
| Molecular Weight | 241.95131 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.95131 Da |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
| SMILES | C1=CC(=C(C=C1C(=O)C(F)(F)F)Cl)Cl |
| InChIKey | YWBUNUGOMAFWHQ-UHFFFAOYSA-N |
Chemical Property Profile of 3',4'-Dichloro-2,2,2-trifluoroacetophenone
Property Insights of 3',4'-Dichloro-2,2,2-trifluoroacetophenone
The XLogP value of 4.2 indicates that 3',4'-Dichloro-2,2,2-trifluoroacetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3',4'-Dichloro-2,2,2-trifluoroacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3',4'-Dichloro-2,2,2-trifluoroacetophenone 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
What is the CAS number of 3',4'-Dichloro-2,2,2-trifluoroacetophenone?
The CAS number of 3',4'-Dichloro-2,2,2-trifluoroacetophenone is 125733-43-9.
What is the molecular formula of 3',4'-Dichloro-2,2,2-trifluoroacetophenone?
The molecular formula of 3',4'-Dichloro-2,2,2-trifluoroacetophenone is C8H3Cl2F3O.
What is the molecular weight of 3',4'-Dichloro-2,2,2-trifluoroacetophenone?
The molecular weight of 3',4'-Dichloro-2,2,2-trifluoroacetophenone is 241.95131 g/mol.
Where can I buy 3',4'-Dichloro-2,2,2-trifluoroacetophenone?
You can request a quote for 3',4'-Dichloro-2,2,2-trifluoroacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3',4'-Dichloro-2,2,2-trifluoroacetophenone?
Yes, CoreyChem provides custom synthesis services for 3',4'-Dichloro-2,2,2-trifluoroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.