4-(4-(Trifluoromethyl)phenoxy)benzaldehyde

Base Information

• Chemical Name: 4-(4-(Trifluoromethyl)phenoxy)benzaldehyde
• CAS No.: 90035-20-4
• Molecular Formula: C14H9 F3 O2
• Molecular Weight: 266.219
• DSSTox Substance ID: DTXSID50535690
• Nikkaji Number: J3.114.875H
• Wikidata: Q72512224
• Mol file: 90035-20-4.mol

Synonyms:4-(4-(Trifluoromethyl)phenoxy)benzaldehyde;90035-20-4;4-(4-Trifluoromethyl-phenoxy)-benzaldehyde;4-[4-(trifluoromethyl)phenoxy]benzaldehyde;4-(4-TRIFLUOROMETHYLPHENOXY)BENZALDEHYDE;MFCD09026265;Benzaldehyde, 4-[4-(trifluoromethyl)phenoxy]-;SCHEMBL184377;DTXSID50535690;AMY36940;4(p-trifluoromethylphenoxy)benzaldehyde;AKOS015920203;DS-13008;SY107675;CS-0157439;4-{[4-(trifluoromethyl)phenyl]oxy}benzaldehyde;O11069;A860926;J-513570

Chemical Property of 4-(4-(Trifluoromethyl)phenoxy)benzaldehyde

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.54
• Boiling Point: 326.855°C at 760 mmHg
• Flash Point: 146.524°C
• PSA: 26.30000
• Density: 1.297g/cm³
• LogP: 4.31020
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 266.05546401
• Heavy Atom Count: 19
• Complexity: 288

Purity/Quality:

97% ^*data from raw suppliers

4-(4-(Trifluoromethyl)phenoxy)benzaldehyde 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C=O)OC2=CC=C(C=C2)C(F)(F)F

Technology Process of 4-(4-(Trifluoromethyl)phenoxy)benzaldehyde

There total 5 articles about 4-(4-(Trifluoromethyl)phenoxy)benzaldehyde 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: 79.2%

→ 4-(4-Trifluoromethylphenoxy)benzaldehyde (90035-20-4)

Guidance literature:

Reference yield: 73.0%

4-hydroxybenzotrifluoride (402-45-9) + 4-fluorobenzaldehyde (459-57-4) → 4-(4-Trifluoromethylphenoxy)benzaldehyde (90035-20-4)

Guidance literature:

With caesium carbonate; In N,N-dimethyl-formamide; at 20 - 85 ℃;

Reference yield: 69.0%

4-hydroxybenzotrifluoride (402-45-9) + 4-nitrobenzaldehdye (555-16-8) → 4-(4-Trifluoromethylphenoxy)benzaldehyde (90035-20-4)

Guidance literature:

With caesium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 5h; Inert atmosphere; Schlenk technique; Green chemistry;

DOI:10.3184/174751917X15122516000113

upstream raw materials:

4-hydroxybenzotrifluoride

4-fluorobenzaldehyde

4-trifluoromethylphenylboronic acid

4-nitrobenzaldehdye

Downstream raw materials:

p-[4-(trifluoromethyl)phenoxy]phenol

cycloheptyl-[4-(4-trifluoromethyl-phenoxy)-benzyl]-amine

N-(4-fluorobenzyl)-1-(4-(4-(trifluoromethyl)phenoxy)phenyl)methanamine

4-(4'-trifluoromethylphenoxy)-benzyl bromide