Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-
TL;DR: Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- (CAS 90830-15-2) is a chemical compound with molecular formula C9H4ClF6NO and molecular weight 290.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2,2,2-trifluoroacetamide
Also Known As: Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-, 4'-Chloro-3'-(trifluoromethyl)-2,2,2-trifluoroacetanilide, Acetamide, N-(4-chloro-3-(trifluoromethyl)phenyl)-2,2,2-trifluoro-, N-[4-chloro-3-(trifluoromethyl)phenyl]-2,2,2-trifluoroacetamide, RefChem:315813
| Molecular Formula | C9H4ClF6NO |
|---|---|
| Molecular Weight | 290.99 g/mol |
| LogP | 3.8596 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.98856 |
| Heavy Atoms | 18 |
| Complexity | 467.10617 |
Chemical Identifiers
| CAS Number | 90830-15-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)C(F)(F)F)C(F)(F)F)Cl |
Product Overview
Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- (CAS 90830-15-2), with molecular formula C9H4ClF6NO and molecular weight 290.99 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2,2,2-trifluoroacetamide.
Chemical Property Profile of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-
Property Insights of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-
The XLogP value of 3.8596 indicates that Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- has 1 hydrogen bond donor(s) and 1 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 Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-?
The CAS number of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- is 90830-15-2.
What is the molecular formula of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-?
The molecular formula of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- is C9H4ClF6NO.
What is the molecular weight of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-?
The molecular weight of Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- is 290.99 g/mol.
Where can I buy Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-?
You can request a quote for Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetanilide, 4'-chloro-2,2,2-trifluoro-3'-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.