Benzenepropanal, 3,5-bis(trifluoroMethyl)- (or 3-[3,5-Bis(trifluoroMethyl)phenyl]propionaldehyde )

Base Information

• Chemical Name: Benzenepropanal, 3,5-bis(trifluoroMethyl)- (or 3-[3,5-Bis(trifluoroMethyl)phenyl]propionaldehyde )
• CAS No.: 1057671-02-9
• Molecular Formula: C11H8F6O
• Molecular Weight: 270.174
• Mol file: 1057671-02-9.mol

Synonyms:Benzenepropanal, 3,5-bis(trifluoroMethyl)- (or 3-[3,5-Bis(trifluoroMethyl)phenyl]propionaldehyde )

Chemical Property of Benzenepropanal, 3,5-bis(trifluoroMethyl)- (or 3-[3,5-Bis(trifluoroMethyl)phenyl]propionaldehyde )

Chemical Property:

• PSA: 17.07000
• LogP: 3.85570

Purity/Quality:

98%min ^*data from raw suppliers

3,5-BIS(TRIFLUOROMETHYL)-BENZENEPROPANAL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzenepropanal, 3,5-bis(trifluoroMethyl)- (or 3-[3,5-Bis(trifluoroMethyl)phenyl]propionaldehyde )

There total 6 articles about Benzenepropanal, 3,5-bis(trifluoroMethyl)- (or 3-[3,5-Bis(trifluoroMethyl)phenyl]propionaldehyde ) 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: 17.0%

3,5-bis(trifluoromethyl)iodobenzene (328-73-4) + allyl alcohol (107-18-6) → 3-(3,5-bis(trifluoromethyl)phenyl)propanal (1057671-02-9)

Guidance literature:

With tetrabutyl-ammonium chloride; palladium diacetate; sodium hydrogencarbonate; In N,N-dimethyl-formamide; at 50 ℃;

DOI:10.1016/j.bmcl.2009.05.119

Reference yield:

carbon monoxide (201230-82-2) + 3,5-bis(trifluoromethyl)styrene (349-59-7) → 3-(3,5-bis(trifluoromethyl)phenyl)propanal (1057671-02-9) + 2-<3,5-bis(trifluoromethyl)phenyl>propanal (155619-05-9)

Guidance literature:

With hydrogen; palladium diacetate; C₃₉H₃₂I₂OP₂Pd; In toluene; at 70 ℃; for 16h; under 75007.5 Torr; Autoclave;

DOI:10.1021/jacs.0c09254

Reference yield:

3,6-bis(trifluoromethyl)bromobenzene (328-70-1) + allyl alcohol (107-18-6) → 3-(3,5-bis(trifluoromethyl)phenyl)propanal (1057671-02-9)

Guidance literature:

With N-Methyldicyclohexylamine; bis(dibenzylideneacetone)-palladium⁽⁰⁾; di‐tert‐butyl‐(1‐phenylindol‐2‐yl)phosphane; In N,N-dimethyl-formamide; at 100 ℃; for 2h; Inert atmosphere;

DOI:10.1021/jacs.8b06871

upstream raw materials:

3,5-bis(trifluoromethyl)iodobenzene

allyl alcohol

3,6-bis(trifluoromethyl)bromobenzene

carbon monoxide

Downstream raw materials:

3-(3,5-bis(trifluoromethyl)phenyl)propan-1-ol

C₁₂H₈F₆N₂S