4-(4-Fluorophenoxy)benzaldehyde

Base Information

• Chemical Name: 4-(4-Fluorophenoxy)benzaldehyde
• CAS No.: 137736-06-2
• Molecular Formula: C13H9FO2
• Molecular Weight: 216.212
• Hs Code.: 2913000090
• European Community (EC) Number: 623-978-6
• DSSTox Substance ID: DTXSID10397413
• Nikkaji Number: J2.646.271A
• Mol file: 137736-06-2.mol

Synonyms:4-(4-Fluorophenoxy)benzaldehyde;137736-06-2;4-(4'-Fluorophenoxy)benzaldehyde;Benzaldehyde, 4-(4-fluorophenoxy)-;4-(4/'-FLUOROPHENOXY)BENZALDEHYDE;MFCD01631896;4-(4-Fluoro-phenoxy)-benzaldehyde;SCHEMBL184204;YUPBWHURNLRZQL-UHFFFAOYSA-;4-(4-fluorophenoxyl)benzaldehyde;DTXSID10397413;YUPBWHURNLRZQL-UHFFFAOYSA-N;4-Fluoro-4'-formyldiphenyl Ether;4-(4-fluoranylphenoxy)benzaldehyde;AR1937;AKOS000260312;AS-8723;4-(4-Fluorophenoxy)benzaldehyde, 97%;AC-10341;CS-0084167;F0537;FT-0643273;EN300-159983;A807301;J-007054;Z335440798;InChI=1/C13H9FO2/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12/h1-9H

Chemical Property of 4-(4-Fluorophenoxy)benzaldehyde

Chemical Property:

• Appearance/Colour: Light yellow powder
• Vapor Pressure: 0.000381mmHg at 25°C
• Melting Point: 77 °C
• Refractive Index: 1.591
• Boiling Point: 317.6 °C at 760 mmHg
• Flash Point: 141.1 °C
• PSA: 26.30000
• Density: 1.229g/cm³
• LogP: 3.43050
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 216.05865769
• Heavy Atom Count: 16
• Complexity: 216

Purity/Quality:

97% ^*data from raw suppliers

4-(4-Fluorophenoxy)benzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn； N
• Hazard Codes: Xn,N
• Statements: 22-41-51/53
• Safety Statements: 26-36/39-60-61

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(4-Fluorophenoxy)benzaldehyde

There total 5 articles about 4-(4-Fluorophenoxy)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: 96.0%

→ 4-(4-fluorophenoxy)benzaldehyde (137736-06-2)

Guidance literature:

Reference yield: 95.0%

4-Fluorophenol (371-41-5) + 4-nitrobenzaldehdye (555-16-8) → 4-(4-fluorophenoxy)benzaldehyde (137736-06-2)

Guidance literature:

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

DOI:10.3184/174751917X15122516000113

Reference yield: 89.0%

4-Fluorophenol (371-41-5) + 4-fluorobenzaldehyde (459-57-4) → 4-(4-fluorophenoxy)benzaldehyde (137736-06-2)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 150 ℃; for 8h;

DOI:10.1016/S0968-0896(97)10009-8

upstream raw materials:

4-Fluorophenol

4-fluorobenzaldehyde

4-hydroxy-benzaldehyde

1-Bromo-4-fluorobenzene

Downstream raw materials:

4-(4-fluorophenoxy)benzaldehyde semicarbazone

4-(4-fluorophenoxy)benzoic acid

4-(4-fluorophenoxy)phenol