1,1'-[Propane-1,3-diyldi(4,1-phenylene)]bis(2-chloroethan-1-one)

Base Information

• Chemical Name: 1,1'-[Propane-1,3-diyldi(4,1-phenylene)]bis(2-chloroethan-1-one)
• CAS No.: 67442-67-5
• Molecular Formula: C19H18Cl2O2
• Molecular Weight: 349.257
• DSSTox Substance ID: DTXSID40532350
• Wikidata: Q82404885

Synonyms:67442-67-5;DTXSID40532350;1,1'-[Propane-1,3-diyldi(4,1-phenylene)]bis(2-chloroethan-1-one)

Chemical Property of 1,1'-[Propane-1,3-diyldi(4,1-phenylene)]bis(2-chloroethan-1-one)

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 348.0683852
• Heavy Atom Count: 23
• Complexity: 345

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CCCC2=CC=C(C=C2)C(=O)CCl)C(=O)CCl

Technology Process of 1,1'-[Propane-1,3-diyldi(4,1-phenylene)]bis(2-chloroethan-1-one)

There total 1 articles about 1,1'-[Propane-1,3-diyldi(4,1-phenylene)]bis(2-chloroethan-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: 97.0%

1,3-diphenylpropane (1081-75-0) + chloroacetyl chloride (79-04-9) → 1,1'-(1,3-propanediyl)bis<(4-chloroacetyl)benzene> (67442-67-5)

Guidance literature:

With aluminum (III) chloride; In dichloromethane; at 20 ℃; Reflux; Inert atmosphere;

DOI:10.1021/jm2014259

Reference yield: 65.0%

2-(N,N-dimethylamino)ethanol (108-01-0) + 1,1'-(1,3-propanediyl)bis<(4-chloroacetyl)benzene> (67442-67-5) → 2,2'-(1,3-propanediyldi-1,4-phenylene)bis<2-hydroxy-4,4-dimethylmorpholinium> dichloride (89302-46-5)

Guidance literature:

In acetone; for 5h;

DOI:10.1021/jm00372a009

Reference yield: 61.0%

1,1'-(1,3-propanediyl)bis<(4-chloroacetyl)benzene> (67442-67-5) → 1,3-bis(4-(2-chloroethyl)phenyl)propane (1361417-82-4)

Guidance literature:

With triethylsilane; trifluoroacetic acid; at 0 - 45 ℃; for 68.33h; Inert atmosphere;

DOI:10.1021/jm2014259

upstream raw materials:

1,3-diphenylpropane

chloroacetyl chloride

Downstream raw materials:

1,3-bis-(4-iodoacetyl-phenyl)-propane

2,2'-(1,3-propanediyldi-1,4-phenylene)bis<2-hydroxy-4,4-dimethylmorpholinium> dichloride

1,3-bis(4-(2-chloroethyl)phenyl)propane

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