2-(Benzyloxy)-3,5-dibromobenzaldehyde

Base Information

• Chemical Name: 2-(Benzyloxy)-3,5-dibromobenzaldehyde
• CAS No.: 61657-63-4
• Molecular Formula: C14H10Br2O2
• Molecular Weight: 370.04
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID10363471
• Nikkaji Number: J1.863.217I
• Wikidata: Q82147179
• Mol file: 61657-63-4.mol

Synonyms:2-(benzyloxy)-3,5-dibromobenzaldehyde;61657-63-4;3,5-dibromo-2-phenylmethoxybenzaldehyde;2-benzyloxy-3,5-dibromobenzaldehyde;SCHEMBL11685931;DTXSID10363471;BBL029655;MFCD02257462;STK353631;AKOS000290589;3,5-Dibromo-2-(benzyloxy)benzaldehyde;UPCMLD0ENAT5243102:001;VS-09348;CS-0221006;EN300-08128;J-506234;Z55928784

Chemical Property of 2-(Benzyloxy)-3,5-dibromobenzaldehyde

Chemical Property:

• Vapor Pressure: 6.27E-08mmHg at 25°C
• Boiling Point: 439.7°C at 760 mmHg
• Flash Point: 219.7°C
• PSA: 26.30000
• Density: 1.696g/cm³
• LogP: 4.60310
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 369.90271
• Heavy Atom Count: 18
• Complexity: 267

Purity/Quality:

99% ^*data from raw suppliers

2-(BENZYLOXY)-3,5-DIBROMOBENZALDEHYDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2Br)Br)C=O

Technology Process of 2-(Benzyloxy)-3,5-dibromobenzaldehyde

There total 3 articles about 2-(Benzyloxy)-3,5-dibromobenzaldehyde 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: 87.0%

3,5-Dibromosalicylaldehyde (90-59-5) + benzyl bromide (100-39-0) → 2-(benzyloxy)-3,5-dibromobenzaldehyde (61657-63-4)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 48h;

DOI:10.1021/acs.jmedchem.9b01004

Reference yield:

3,5-Dibromosalicylaldehyde (90-59-5) → 2-(benzyloxy)-3,5-dibromobenzaldehyde (61657-63-4)

Guidance literature:

With potassium carbonate; In acetone; for 3h; Reflux;

DOI:10.1016/j.tetlet.2011.03.018

Reference yield:

3,5-Dibromosalicylaldehyde (90-59-5) + benzyl chloride (100-44-7) → 2-(benzyloxy)-3,5-dibromobenzaldehyde (61657-63-4)

Guidance literature:

With potassium hydroxide;

DOI:10.1021/jo01205a008

upstream raw materials:

3,5-Dibromosalicylaldehyde

benzyl chloride

benzyl bromide

Downstream raw materials:

1-(2-(benzyloxy)-3,5-dibromophenyl)hex-2-yn-1-one

3-benzyl-6,8-dibromo-2-propyl-4H-chromen-4-one

Refernces

• 1、 Del Poeta, Maurizio,Haranahalli, Krupanandan,Lazzarini, Cristina,Mallamo, John,McCarthy, J. Brian,Ojima, Iwao,Pathiranage, Senuri,Sun, Yi,Zambito, Julia. "SAR Studies on Aromatic Acylhydrazone-Based Inhibitors of Fungal Sphingolipid Synthesis as Next-Generation Antifungal Agents". . . Retrieved 2019/09/06.
• 2、 Kaye, Perry T.,Musa, Musiliyu A.. "A convenient and improved Baylis-Hillman synthesis of 3-substututed 2H-1-benzopyran-2-ones". . p. 2701 - 2706. Retrieved 2007/10/03.