2-[(4-Bromobenzyl)oxy]benzaldehyde

Base Information

• Chemical Name: 2-[(4-Bromobenzyl)oxy]benzaldehyde
• CAS No.: 101046-14-4
• Molecular Formula: C14H11BrO2
• Molecular Weight: 291.144
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID40352777
• Wikidata: Q82130114
• Mol file: 101046-14-4.mol

Synonyms:2-[(4-bromobenzyl)oxy]benzaldehyde;101046-14-4;2-[(4-bromophenyl)methoxy]benzaldehyde;2-((4-bromobenzyl)oxy)benzaldehyde;MFCD00595786;Cambridge id 5285265;DTXSID40352777;BBL013980;STK198702;AKOS000249593;VS-04085;CS-0116924;EN300-228649;AB00079242-01;SR-01000203367;SR-01000203367-1;F3099-6613

Chemical Property of 2-[(4-Bromobenzyl)oxy]benzaldehyde

Chemical Property:

• Vapor Pressure: 5.11E-07mmHg at 25°C
• Boiling Point: 412.6oC at 760 mmHg
• Flash Point: 203.3oC
• PSA: 26.30000
• Density: 1.441g/cm3
• LogP: 3.84060
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 289.99424
• Heavy Atom Count: 17
• Complexity: 236

Purity/Quality:

97% ^*data from raw suppliers

2-[(4-Bromobenzyl)oxy]benzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C=O)OCC2=CC=C(C=C2)Br

Technology Process of 2-[(4-Bromobenzyl)oxy]benzaldehyde

There total 2 articles about 2-[(4-Bromobenzyl)oxy]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: 81.0%

salicylaldehyde (90-02-8) + 1-bromomethyl-4-bromobenzene (589-15-1) → 2-((4-bromobenzyl)oxy)benzaldehyde (101046-14-4)

Guidance literature:

With potassium hydroxide;

DOI:10.1246/bcsj.58.2192

Reference yield:

→ 2-((4-bromobenzyl)oxy)benzaldehyde (101046-14-4)

Guidance literature:

/BRN= 2976096/;

Reference yield: 92.0%

2-((4-bromobenzyl)oxy)benzaldehyde (101046-14-4) → 2-((4-bromobenzyl)oxy)benzaldoxime

Guidance literature:

With hydroxylamine hydrochloride; sodium acetate; In tetrahydrofuran; ethanol; water; at 20 ℃; for 6h;

DOI:10.1021/jo010895d

upstream raw materials:

salicylaldehyde

1-bromomethyl-4-bromobenzene

Downstream raw materials:

2-(4-bromo-benzyloxy)-benzaldehyde oxime

3-[2-(4-bromo-benzyloxy)-phenyl]-5-chloromethyl-isoxazole

methyl 3-(2-((4-bromobenzyl)oxy)phenyl)-5-(4-methoxybenzoyl)-4,5-dihydroisoxazolo-5-carboxylate