2-Chloro-1-(2-chlorophenyl)propan-1-one

Base Information

• Chemical Name: 2-Chloro-1-(2-chlorophenyl)propan-1-one
• CAS No.: 81671-55-8
• Molecular Formula: C9H8Cl2O
• Molecular Weight: 203.06522
• DSSTox Substance ID: DTXSID50510366
• Mol file: 81671-55-8.mol

Synonyms:2-chloro-1-(2-chlorophenyl)propan-1-one;81671-55-8;DTXSID50510366

Chemical Property of 2-Chloro-1-(2-chlorophenyl)propan-1-one

Chemical Property:

• PSA: 17.07000
• LogP: 3.15000
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 201.9952203
• Heavy Atom Count: 12
• Complexity: 170

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

2,2'-Dichloropropiophenone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)C1=CC=CC=C1Cl)Cl

Technology Process of 2-Chloro-1-(2-chlorophenyl)propan-1-one

There total 1 articles about 2-Chloro-1-(2-chlorophenyl)propan-1-one 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:

2-chloropropiophenone (6323-18-8) → 1-(o-chlorophenyl)-2-chloro-1-propanone (81671-55-8)

Guidance literature:

With hydrogenchloride; chlorine; Yield given. Multistep reaction; 1.) CH₂Cl₂, 0 deg C, 1 h, 2.) RT, overnight;

DOI:10.1021/jo00135a027

Reference yield: 84.0%

1-(o-chlorophenyl)-2-chloro-1-propanone (81671-55-8) → 1-(o-chlorophenyl)-2-bromo-2-chloro-1-propanone (81671-56-9)

Guidance literature:

With N-Bromosuccinimide; In tetrachloromethane; for 6h; Heating; Irradiation;

DOI:10.1021/jo00135a027 DOI:10.1055/s-1982-29920

Reference yield:

1-(o-chlorophenyl)-2-chloro-1-propanone (81671-55-8) → 1-(o-chlorophenyl)-2-bromo-2-chloro-1-propanol (81671-54-7)

Guidance literature:

Multi-step reaction with 2 steps

1: 84 percent / N-bromosuccinimide / CCl₄ / 6 h / Heating; Irradiation

2: 92 percent / BH₃:(H₃C)2S / diethyl ether / 24 h / Heating; further reducing agents

With N-Bromosuccinimide; dimethylsulfide borane complex; In tetrachloromethane; diethyl ether;

DOI:10.1055/s-1982-29920

upstream raw materials:

2-chloropropiophenone

Downstream raw materials:

1-(o-chlorophenyl)-2-bromo-2-chloro-1-propanone

1-(o-chlorophenyl)-2-bromo-2-chloro-1-propanol

1-(o-chlorophenyl)-2-bromo-2-chloro-1-propyl trifluoroacetate