3,4-Dibromo-4-(4-chlorophenyl)-2-butanone

Base Information

• Chemical Name: 3,4-Dibromo-4-(4-chlorophenyl)-2-butanone
• CAS No.: 343375-52-0
• Molecular Formula: C₁₀H₉Br₂ClO
• Molecular Weight: 340.442
• DSSTox Substance ID: DTXSID901272005
• Mol file: 343375-52-0.mol

Synonyms:3,4-dibromo-4-(4-chlorophenyl)-2-butanone;3,4-dibromo-4-(4-chlorophenyl)butan-2-one;343375-52-0;DTXSID901272005;AKOS005098626;7C-050

Chemical Property of 3,4-Dibromo-4-(4-chlorophenyl)-2-butanone

Chemical Property:

• Boiling Point: 339.1±42.0 °C(Predicted)
• Density: 1.774±0.06 g/cm3(Predicted)
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 339.86882
• Heavy Atom Count: 14
• Complexity: 202

Purity/Quality:

3,4-Dibromo-4-(4-chlorophenyl)-2-butanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of 3,4-Dibromo-4-(4-chlorophenyl)-2-butanone

There total 3 articles about 3,4-Dibromo-4-(4-chlorophenyl)-2-butanone 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: 94.0%

4-(4-chlorophenyl)-3-buten-2-one (3160-40-5) → (trans)-3,4-dibromo-4-(4-chlorophenyl)butan-2-one (343375-52-0)

Guidance literature:

With N-Bromosuccinimide; dimanganese decacarbonyl; In 1,2-dichloro-ethane; at 110 ℃; for 12h; Schlenk technique;

DOI:10.1039/d1cc04534b

Reference yield:

4-(4-chlorophenyl)-3-buten-2-one (3160-40-5) → 3,4-dibromo-4-(4-chloro-phenyl)-butan-2-one (343375-52-0)

Guidance literature:

With bromine; In dichloromethane; at 0 ℃;

DOI:10.1002/chem.201002395

Reference yield:

→ 3,4-dibromo-4-(4-chloro-phenyl)-butan-2-one (343375-52-0)

Guidance literature:

With tetrachloromethane; bromine;

DOI:10.1021/jo01158a007

upstream raw materials:

4-(4-chlorophenyl)-3-buten-2-one

Downstream raw materials:

4-(4-chloro-phenyl)-3,4-dimorpholino-butan-2-one

(3E)-4-(4-chlorophenyl)-3-buten-2-one

(E)-1-bromo-4-(4-chlorophenyl)but-3-en-2-one

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