3,5-Trifluromethylbenzoylacetonitrile

Base Information

• Chemical Name: 3,5-Trifluromethylbenzoylacetonitrile
• CAS No.: 267880-81-9
• Molecular Formula: C11H5 F6 N O
• Molecular Weight: 281.15
• Hs Code.: 2926909090
• Mol file: 267880-81-9.mol

Synonyms:3,5-Trifluromethylbenzoylacetonitrile

Chemical Property of 3,5-Trifluromethylbenzoylacetonitrile

Chemical Property:

• Vapor Pressure: 0.023mmHg at 25°C
• Melting Point: 67-70 °C
• Refractive Index: 1.426
• Boiling Point: 249.3°Cat760mmHg
• PKA: 6.32±0.10(Predicted)
• Flash Point: 104.6°C
• PSA: 40.86000
• Density: 1.42g/cm³
• LogP: 3.82058

Purity/Quality:

97% ^*data from raw suppliers

3,5-bis(trifluoromethyl)benzoylacetonitrile 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3,5-Trifluromethylbenzoylacetonitrile

There total 3 articles about 3,5-Trifluromethylbenzoylacetonitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 76.0%

sodium cyanide (773837-37-9) + 2-bromo-1-[3,5-di(trifluoromethyl)phenyl]ethan-1-one (131805-94-2) → 3,5-bis(trifluoromethyl)benzoyl acetonitrile (267880-81-9)

Guidance literature:

In water; N,N-dimethyl-formamide; at 20 ℃; chemoselective reaction;

Reference yield: 25.0%

sodium cyanide (773837-37-9) + 2-bromo-1-[3,5-di(trifluoromethyl)phenyl]ethan-1-one (131805-94-2) → 3,5-bis(trifluoromethyl)benzoyl acetonitrile (267880-81-9) + C20H9BrF12O2

Guidance literature:

In ethanol; water; at 20 ℃;

Reference yield:

→ 3,5-bis(trifluoromethyl)benzoyl acetonitrile (267880-81-9)

Guidance literature:

upstream raw materials:

sodium cyanide

2-bromo-1-[3,5-di(trifluoromethyl)phenyl]ethan-1-one

Downstream raw materials:

2-(3,5-bis(trifluoromethyl)phenyl)-9-chlorobenzo[h][1,6]naphthyridine-3-carbonitrile

5-amino-3-(3,5-bis(trifluoromethyl)phenyl)thiophene-2,4-dicarboxamide

N-(3,5-dicyano-4-(3,5-bis(trifluoromethyl)phenyl)thiophen-2-yl)acetamide

5-amino-3-(3,5-bis(trifluoromethyl)phenyl)thiophene-2,4-dicarbonitrile

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