1-[4-(2-Chlorophenyl)phenyl]ethanone

Base Information

• Chemical Name: 1-[4-(2-Chlorophenyl)phenyl]ethanone
• CAS No.: 3808-89-7
• Molecular Formula: C14H11ClO
• Molecular Weight: 230.694
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID401273189
• Nikkaji Number: J132.619H
• Mol file: 3808-89-7.mol

Synonyms:3808-89-7;1-[4-(2-chlorophenyl)phenyl]ethanone;4-Acetyl-2'-chlorobiphenyl;1-(2'-CHLORO-BIPHENYL-4-YL)-ETHANONE;1-(2'-Chloro[1,1'-biphenyl]-4-yl)ethanone;Acetophenone, 4'-(o-chlorophenyl)-;Ethanone, 1-(2'-chloro[1,1'-biphenyl]-4-yl)-;1-(2'-chloro-[1,1'-biphenyl]-4-yl)ethan-1-one;SCHEMBL7367799;4'-(2-chlorophenyl)acetophenone;2-Chloro-4\'-phenylacetophenone;DTXSID401273189;MFCD01830348;2'-Chloro-4-biphenylyl methyl ketone;AKOS004113780;BB 0222556;1-(2'-Chloro[1,1-biphenyl]-4-yl)ethanone;1-(2'-Chloro[1,1'-biphenyl]-4-yl)ethanone #;AA-516/30040018

Chemical Property of 1-[4-(2-Chlorophenyl)phenyl]ethanone

Chemical Property:

• PSA: 17.07000
• LogP: 4.20960
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 230.0498427
• Heavy Atom Count: 16
• Complexity: 243

Purity/Quality:

98% ^*data from raw suppliers

1-(2'-CHLORO[1,1-BIPHENYL]-4-YL)ETHANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2Cl

Technology Process of 1-[4-(2-Chlorophenyl)phenyl]ethanone

There total 1 articles about 1-[4-(2-Chlorophenyl)phenyl]ethanone 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:

4-acetyl-2'-chlorobiphenyl cyanohydrin → hydrogen cyanide (74-90-8) + 4'-(2-chlorophenyl)acetophenone (3808-89-7)

Guidance literature:

In 1,4-dioxane; water; at 30 ℃; Equilibrium constant;

Reference yield:

4'-(2-chlorophenyl)acetophenone (3808-89-7) → 2-acetylcarbazole (23592-74-7)

Guidance literature:

Multi-step reaction with 3 steps

1.1: bis(bis(trimethylsilyl)amido)zinc(II); tri-tert-butyl phosphine; lithium chloride; bis(dibenzylideneacetone)-palladium⁽⁰⁾ / tetrahydrofuran / Inert atmosphere

1.2: Inert atmosphere

2.1: sodium azide; acetic acid; sodium nitrite / water / 0.5 h / 0 - 20 °C / Inert atmosphere

3.1: 5,5-dimethyl-1,3-cyclohexadiene / 150 °C / Inert atmosphere; sealed tube

With bis(bis(trimethylsilyl)amido)zinc(II); sodium azide; tri-tert-butyl phosphine; acetic acid; lithium chloride; bis(dibenzylideneacetone)-palladium⁽⁰⁾; sodium nitrite; In tetrahydrofuran; 5,5-dimethyl-1,3-cyclohexadiene; water; 1.1: Buchwald-Hartwig amination;

DOI:10.1002/ejoc.201200160

Downstream raw materials:

2-acetylcarbazole