N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide
TL;DR: N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide (CAS 404-25-1) is a chemical compound with molecular formula C8H5ClF3NO and molecular weight 223.00117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-chlorophenyl)-2,2,2-trifluoroacetamide
Also Known As: N-(4-chlorophenyl)-2,2,2-trifluoroacetamide, Acetamide, N-(4-chlorophenyl)-2,2,2-trifluoro-, 4'-Chloro-2,2,2-trifluoroacetanilide, ACETANILIDE, 4'-CHLORO-2,2,2-TRIFLUORO-, N-(Trifluoroacetyl)-4-chloroaniline
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H5ClF3NO |
| Molecular Weight | 223.00117 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.00117 Da |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
| SMILES | C1=CC(=CC=C1NC(=O)C(F)(F)F)Cl |
| InChIKey | PEFCIPXJRCETGI-UHFFFAOYSA-N |
Product Description
Applications: N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide (CAS 404-25-1) is a heterocyclic building block with the molecular formula C8H5ClF3NO and a molecular weight of 223 g/mol. Synonyms include N-(4-chlorophenyl)-2,2,2-trifluoroacetamide and Acetamide, N-(4-chlorophenyl)-2,2,2-trifluoro-.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide
Property Insights of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide
The XLogP value of 3.3 indicates that N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide 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
What is the CAS number of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide?
The CAS number of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide is 404-25-1.
What is the molecular formula of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide?
The molecular formula of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide is C8H5ClF3NO.
What is the molecular weight of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide?
The molecular weight of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide is 223.00117 g/mol.
What are the applications of N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide?
N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as...
Where can I buy N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide?
You can request a quote for N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide?
Yes, CoreyChem provides custom synthesis services for N-(4-Chlorophenyl)-2,2,2-trifluoroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.