1-(Benzyloxy)-2-bromo-4-methylbenzene

Base Information

• Chemical Name: 1-(Benzyloxy)-2-bromo-4-methylbenzene
• CAS No.: 2830-53-7
• Molecular Formula: C14H13BrO
• Molecular Weight: 277.161
• Hs Code.: 2909309090
• DSSTox Substance ID: DTXSID00444127
• Nikkaji Number: J1.054.549H
• Wikidata: Q82262151
• Mol file: 2830-53-7.mol

Synonyms:2830-53-7;1-(benzyloxy)-2-bromo-4-methylbenzene;1-Benzyloxy-2-bromo-4-methylbenzene;4-Benzoxyl-3-bromotoluene;2-bromo-4-methyl-1-phenylmethoxybenzene;MFCD09753753;1-(Benzyloxy)-2-bromo-4-methylbenzene;3-bromo-4-benzyloxytoluene;4-(Benzyloxy)-3-bromotoluene;SCHEMBL1855654;2-Benzyloxy-5-methylbromobenzene;DTXSID00444127;VKHZSLPJRBZFCI-UHFFFAOYSA-N;2-Bromo-4-methylphenylbenzyl ether;CAA83053;AKOS008912773;AC-5448;BS-27760;SY239888;CS-0328140;A856702

Chemical Property of 1-(Benzyloxy)-2-bromo-4-methylbenzene

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 354.674oC at 760 mmHg
• Flash Point: 144.603oC
• PSA: 9.23000
• Density: 1.342g/cm3
• LogP: 4.33650
• Storage Temp.: Room temperature.
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 276.01498
• Heavy Atom Count: 16
• Complexity: 201

Purity/Quality:

97% ^*data from raw suppliers

1-Benzyloxy-2-bromo-4-methylbenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)OCC2=CC=CC=C2)Br

Technology Process of 1-(Benzyloxy)-2-bromo-4-methylbenzene

There total 4 articles about 1-(Benzyloxy)-2-bromo-4-methylbenzene 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: 100.0%

2-bromo-p-cresol (6627-55-0) + benzyl bromide (100-39-0) → 1-(benzyloxy)-2-bromo-4-methylbenzene (2830-53-7)

Guidance literature:

With potassium carbonate; In acetone; for 20h; Heating;

DOI:10.1021/ol702879u

Reference yield: 72.0%

2-bromo-p-cresol (6627-55-0) + benzyl chloride (100-44-7) → 1-(benzyloxy)-2-bromo-4-methylbenzene (2830-53-7)

Guidance literature:

With potassium carbonate; In acetonitrile; Heating;

DOI:10.1021/jo060271d

Reference yield:

2-bromo-4-methylanisole (22002-45-5) → 1-(benzyloxy)-2-bromo-4-methylbenzene (2830-53-7)

Guidance literature:

Multi-step reaction with 2 steps

1: boron tribromide / dichloromethane / 2 h / -78 - 20 °C

2: potassium carbonate / N,N-dimethyl-formamide / 12 h / 70 °C

With boron tribromide; potassium carbonate; In dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/ol202473w

upstream raw materials:

2-bromo-p-cresol

benzyl chloride

benzyl bromide

2-bromo-4-methylanisole

Downstream raw materials:

4-Benzyloxy-3-(4-methyl-phenoxy)-toluol

2-(2-Benzyloxy-5-methyl-phenyl)-cyclohepta-2,4,6-trienone

(R)-3-[(R)-3-(2-benzyloxy-5-methylphenyl)-3-phenylpropionyl]-4-phenyloxazolidin-2-one

2-benzyloxy-5-methylbenzenesulfonyl chloride