1-Bromo-4-(2-butoxyethoxy)benzene

Base Information

• Chemical Name: 1-Bromo-4-(2-butoxyethoxy)benzene
• CAS No.: 39255-24-8
• Molecular Formula: C12H17 Br O2
• Molecular Weight: 273.17
• DSSTox Substance ID: DTXSID401300918
• Nikkaji Number: J2.174.418B
• Mol file: 39255-24-8.mol

Synonyms:1-bromo-4-(2-butoxyethoxy)benzene;39255-24-8;1-Bromo-4-[2-(butoxy)ethoxy]benzene;C12H17BrO2;BEB;SCHEMBL6516509;DTXSID401300918;AB91715;CS-15727;2-(4-Bromophenoxy)ethanol, n-butyl ether;CS-0040731;D72679

Chemical Property of 1-Bromo-4-(2-butoxyethoxy)benzene

Chemical Property:

• Boiling Point: 324.9±22.0 °C(Predicted)
• PSA: 18.46000
• Density: 1.250±0.06 g/cm3(Predicted)
• LogP: 3.64460
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 272.04119
• Heavy Atom Count: 15
• Complexity: 145

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCOCCOC1=CC=C(C=C1)Br

Technology Process of 1-Bromo-4-(2-butoxyethoxy)benzene

There total 4 articles about 1-Bromo-4-(2-butoxyethoxy)benzene 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: 98.0%

1-bromo-butane (109-65-9) + 2-(4-bromophenoxy)ethanol (34743-88-9) → 1-bromo-4-[2-(butoxy)ethoxy]benzene (39255-24-8)

Guidance literature:

With tetra(n-butyl)ammonium hydrogensulfate; sodium hydroxide; In water; dimethyl sulfoxide; at 35 - 40 ℃; for 1.5h;

DOI:10.1021/op0497916

Reference yield: 64.0%

4-bromo-phenol (106-41-2) + 1-(2-chloroethoxy)butane (10503-96-5) → 1-bromo-4-[2-(butoxy)ethoxy]benzene (39255-24-8)

Guidance literature:

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

DOI:10.1248/cpb.52.577

Reference yield:

1-iodo-butane (542-69-8) + 2-(4-bromophenoxy)ethanol (34743-88-9) → 1-bromo-4-[2-(butoxy)ethoxy]benzene (39255-24-8)

Guidance literature:

In water; N,N-dimethyl-formamide;

upstream raw materials:

4-bromo-phenol

1-(2-chloroethoxy)butane

1-iodo-butane

2-(4-bromophenoxy)ethanol

Downstream raw materials:

7-{4-[2-(butoxy)ethoxy]phenyl}-1-propyl-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid

(S)-8-(4-(2-butoxyethoxy)phenyl)-1-isobutyl-N-(4-(((1-propyl-1H-imidazol-5-yl)methyl)sulfinyl)phenyl)-1,2,3,4-tetrahydrobenzo[b]azocine-5-carboxamide methanesulfonate

7-{4-[2-(butoxy)ethoxy]phenyl}-N-(4-{[methyl(tetrahydro-2H-pyran-4-yl)amino]methyl}phenyl)-1-propyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide

7-{4-[2-(butoxy)ethoxy]phenyl}-1-cyclohexylmethyl-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid

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