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2,2,2-Trifluoro-N-(6-oxo-6-phenylhexyl)acetamide is a synthetic organic compound characterized by the presence of fluorine, nitrogen, oxygen, and carbon atoms. It is an acetamide derivative with a trifluoromethyl group attached to the nitrogen atom and features a phenyl group connected to the sixth carbon of the hexyl chain. This versatile molecule serves as a valuable building block in pharmaceutical research, facilitating the development of innovative drugs and therapeutic agents. The incorporation of the trifluoromethyl group endows the compound with distinct physicochemical and pharmacological properties, enhancing its utility in medicinal chemistry applications.

39510-50-4

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39510-50-4 Usage

Uses

Used in Pharmaceutical Research and Development:
2,2,2-Trifluoro-N-(6-oxo-6-phenylhexyl)acetamide is utilized as a key building block in the pharmaceutical industry for the synthesis of new drugs and therapeutic agents. Its unique structure and properties contribute to the discovery of novel compounds with potential medicinal applications.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 2,2,2-trifluoro-N-(6-oxo-6-phenylhexyl)acetamide is employed as a versatile compound to explore and enhance the physicochemical and pharmacological properties of drug candidates. The presence of the trifluoromethyl group can significantly influence the compound's lipophilicity, metabolic stability, and binding affinity to biological targets, thereby improving the overall drug performance.
Used in Drug Design and Optimization:
2,2,2-Trifluoro-N-(6-oxo-6-phenylhexyl)acetamide serves as a valuable component in drug design and optimization processes. Its incorporation into drug molecules can lead to the development of more effective and selective therapeutic agents with improved pharmacokinetic and pharmacodynamic profiles.
Used in Biochemical and Biomedical Research:
2,2,2-trifluoro-N-(6-oxo-6-phenylhexyl)acetamide is also used in biochemical and biomedical research to study the interactions between small molecules and biological targets, such as enzymes, receptors, and other macromolecules. The unique structural features of 2,2,2-trifluoro-N-(6-oxo-6-phenylhexyl)acetamide make it a useful tool for probing the structure-activity relationships and understanding the molecular mechanisms underlying various biological processes.

Check Digit Verification of cas no

The CAS Registry Mumber 39510-50-4 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,9,5,1 and 0 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 39510-50:
(7*3)+(6*9)+(5*5)+(4*1)+(3*0)+(2*5)+(1*0)=114
114 % 10 = 4
So 39510-50-4 is a valid CAS Registry Number.

39510-50-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,2,2-trifluoro-N-(6-oxo-6-phenylhexyl)acetamide

1.2 Other means of identification

Product number -
Other names 6-amino-1-phenyl-hexan-1-one

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:39510-50-4 SDS

39510-50-4Downstream Products

39510-50-4Relevant academic research and scientific papers

Chemoenzymatic Synthesis of Substituted Azepanes by Sequential Biocatalytic Reduction and Organolithium-Mediated Rearrangement

Zawodny, Wojciech,Montgomery, Sarah L.,Marshall, James R.,Finnigan, James D.,Turner, Nicholas J.,Clayden, Jonathan

supporting information, p. 17872 - 17877 (2019/01/04)

Enantioenriched 2-aryl azepanes and 2-arylbenzazepines were generated biocatalytically by asymmetric reductive amination using imine reductases or by deracemization using monoamine oxidases. The amines were converted to the corresponding N′-aryl ureas, which rearranged on treatment with base with stereospecific transfer of the aryl substituent to the 2-position of the heterocycle via a configurationally stable benzyllithium intermediate. The products are previously inaccessible enantioenriched 2,2-disubstituted azepanes and benzazepines.

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