2-Amino-1-(4-bromophenyl)-1-ethanol

Base Information

• Chemical Name: 2-Amino-1-(4-bromophenyl)-1-ethanol
• CAS No.: 41147-82-4
• Molecular Formula: C8H10BrNO
• Molecular Weight: 216.077
• Hs Code.: 2921490090
• DSSTox Substance ID: DTXSID90547797
• Nikkaji Number: J532.116F
• Mol file: 41147-82-4.mol

Synonyms:41147-82-4;2-AMINO-1-(4-BROMOPHENYL)-1-ETHANOL;2-amino-1-(4-bromophenyl)ethanol;2-amino-1-(4-bromophenyl)ethan-1-ol;4-Bromo-beta-hydroxyphenethylamine;MFCD08276931;4-Bromo-b-hydroxyphenethylamine;4-bromophenylethanolamine;SCHEMBL1241889;DTXSID90547797;RETMUAMXYIIWAQ-UHFFFAOYSA-N;2-Amino-1-(4-bromo-phenyl)-ethanol;AKOS005069624;AM803872;SY104208;CS-0046949;EN300-314893;11Z-0710;J-507721

Chemical Property of 2-Amino-1-(4-bromophenyl)-1-ethanol

Chemical Property:

• Melting Point: 111-113°
• Boiling Point: 341.6±27.0 °C(Predicted)
• PKA: 11.83±0.35(Predicted)
• Density: 1.539±0.06 g/cm3(Predicted)
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 214.99458
• Heavy Atom Count: 11
• Complexity: 113

Purity/Quality:

98%min ^*data from raw suppliers

2-Amino-1-(4-bromophenyl)-1-ethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(CN)O)Br

Technology Process of 2-Amino-1-(4-bromophenyl)-1-ethanol

There total 8 articles about 2-Amino-1-(4-bromophenyl)-1-ethanol 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: 95.0%

4-bromophenacylamine (7644-04-4) → 4-Bromophenylethanolamine (41147-82-4)

Guidance literature:

With potassium hydroxide; In isopropyl alcohol; at 100 ℃; Microwave irradiation;

DOI:10.1016/j.tetlet.2009.01.014

Reference yield: 87.0%

(+/-)-2-(4-bromophenyl)oxirane (32017-76-8) → 4-Bromophenylethanolamine (41147-82-4)

Guidance literature:

(+/-)-2-(4-bromophenyl)oxirane; With sodium hexamethyldisilazane; In tetrahydrofuran; at 0 - 25 ℃; for 14h;

With water; In tetrahydrofuran; at 25 ℃; for 5h; regioselective reaction;

DOI:10.1016/j.tetlet.2012.08.013

Reference yield: 77.0%

α-amino-4-bromoacetophenone hydrochloride (5467-72-1) → 4-Bromophenylethanolamine (41147-82-4)

Guidance literature:

α-amino-4-bromoacetophenone hydrochloride; With potassium hydroxide; sodium tetrahydroborate; In methanol; at 20 ℃; for 0.2h;

With water; sodium hydrogencarbonate;

upstream raw materials:

2-azido-1-(4-bromophenyl)ethanone

2-(4-bromophenyl)-2-oxoacetaldehyde oxime

2-(4-bromophenyl)-2-hydroxyacetonitrile

α-amino-4-bromoacetophenone hydrochloride

Downstream raw materials:

2-[2-(4-bromophenyl)-2-hydroxyethylamino]-4,6-dichloropyrimidine

6-[2-(4-bromophenyl)-2-hydroxyethylamino]-2,4-dichloropyrimidine

(RS)-2-(4-bromophenyl)morpholine

tert-butyl (2-(4-bromophenyl)-2-hydroxyethyl)carbamate

Refernces

• 1、 Legnani, Luca,Morandi, Bill. "Direct catalytic synthesis of unprotected 2-amino-1-phenylethanols from alkenes by using iron(II) phthalocyanine". supporting information. p. 2248 - 2251. Retrieved 2016/02/18.
• 2、 Baruwati, Babita,Polshettiwar, Vivek,Varma, Rajender S.. "Magnetically recoverable supported ruthenium catalyst for hydrogenation of alkynes and transfer hydrogenation of carbonyl compounds". scheme or table. p. 1215 - 1218. Retrieved 2009/05/27.