4-[(3-Chlorophenyl)methoxy]benzaldehyde

Base Information

• Chemical Name: 4-[(3-Chlorophenyl)methoxy]benzaldehyde
• CAS No.: 59067-43-5
• Molecular Formula: C14H11 Cl O2
• Molecular Weight: 246.693
• DSSTox Substance ID: DTXSID60352779
• Wikidata: Q82130117
• ChEMBL ID: CHEMBL2088926
• Mol file: 59067-43-5.mol

Synonyms:59067-43-5;4-[(3-Chlorobenzyl)Oxy]Benzenecarbaldehyde;4-[(3-chlorophenyl)methoxy]benzaldehyde;4-[(3-chlorobenzyl)oxy]benzaldehyde;4-((3-Chlorobenzyl)oxy)benzaldehyde;4-(3-Chlorobenzyloxy)benzaldehyde;MFCD02091000;SCHEMBL3423658;CHEMBL2088926;DTXSID60352779;QLYLREZHERJGAH-UHFFFAOYSA-N;4-(3-chlorobenzyloxy)-benzaldehyde;4-(3-Chloro-benzyloxy)-benzaldehyde;BBL014017;STK198941;AKOS000202334;NCGC00341004-01;4-[(3-Chlorobenzyl)oxy]benzene carbaldehyde;CS-0312646;FT-0640576;F81788;AB01249055-03;12P-014;A832140;SR-01000264435;J-513153;SR-01000264435-1

Chemical Property of 4-[(3-Chlorophenyl)methoxy]benzaldehyde

Chemical Property:

• Vapor Pressure: 2.07E-06mmHg at 25°C
• Melting Point: 53-55°C
• Boiling Point: 393.9°C at 760 mmHg
• Flash Point: 164.7°C
• PSA: 26.30000
• Density: 1.247g/cm³
• LogP: 3.73150
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 246.0447573
• Heavy Atom Count: 17
• Complexity: 236

Purity/Quality:

98%Min ^*data from raw suppliers

4-[(3-Chlorobenzyl)oxy]benzenecarbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)Cl)COC2=CC=C(C=C2)C=O

Technology Process of 4-[(3-Chlorophenyl)methoxy]benzaldehyde

There total 4 articles about 4-[(3-Chlorophenyl)methoxy]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: 96.6%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 1-bromomethyl-3-chlorobenzene (766-80-3) → 4-(3-chloro benzyloxy) benzaldehyde (59067-43-5)

Guidance literature:

With potassium carbonate; potassium iodide; In acetone; at 70 ℃; for 2h;

Reference yield: 96.2%

→ 4-(3-chloro benzyloxy) benzaldehyde (59067-43-5)

Guidance literature:

With potassium carbonate; In acetone; at 60 ℃; for 5h;

Reference yield: 83.0%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 1-Chloro-3-chloromethyl-benzene (620-20-2,130468-19-8) → 4-(3-chloro benzyloxy) benzaldehyde (59067-43-5)

Guidance literature:

With sodium carbonate; In N,N-dimethyl-formamide; at 80 ℃;

DOI:10.1016/j.bioorg.2021.105170

upstream raw materials:

4-hydroxy-benzaldehyde

1-bromomethyl-3-chlorobenzene

ethanol

1-Chloro-3-chloromethyl-benzene

Downstream raw materials:

[4-(3-chlorobenzyloxy)benzyl]amino acetic acid, ethyl ester

(E)-4-[4-(3-Chloro-benzyloxy)-phenyl]-1-morpholin-4-yl-but-3-en-2-ol

(S,E)-2-(5-(4-(3-chlorobenzyloxy)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-3-phenylpropanoic acid

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