2-Propen-1-one, 1,2-bis(2,4-dichlorophenyl)-

Base Information

• Chemical Name: 2-Propen-1-one, 1,2-bis(2,4-dichlorophenyl)-
• CAS No.: 104941-05-1
• Molecular Formula: C15H8 Cl4 O
• Molecular Weight: 346.0354
• DSSTox Substance ID: DTXSID50146861
• Wikidata: Q83011758
• ChEMBL ID: CHEMBL36112
• Mol file: 104941-05-1.mol

Synonyms:104941-05-1;2-Propen-1-one, 1,2-bis(2,4-dichlorophenyl)-;1,2-bis(2,4-dichlorophenyl)prop-2-en-1-one;CHEMBL36112;DTXSID50146861

Chemical Property of 2-Propen-1-one, 1,2-bis(2,4-dichlorophenyl)-

Chemical Property:

• Vapor Pressure: 1.99E-09mmHg at 25°C
• Boiling Point: 481.4°C at 760 mmHg
• Flash Point: 202.1°C
• Density: 1.427g/cm³
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 345.929976
• Heavy Atom Count: 20
• Complexity: 384

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C(C1=C(C=C(C=C1)Cl)Cl)C(=O)C2=C(C=C(C=C2)Cl)Cl

Technology Process of 2-Propen-1-one, 1,2-bis(2,4-dichlorophenyl)-

There total 3 articles about 2-Propen-1-one, 1,2-bis(2,4-dichlorophenyl)- 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: 66.0%

bis-(dimethylamino)methane (51-80-9) + 2-(2,4-dichlorophenyl)-2',4'-dichloroacetophenone (107680-34-2) → 1,2-Bis-(2,4-dichloro-phenyl)-propenone (104941-05-1)

Guidance literature:

In acetic anhydride; at 50 ℃; for 0.5h;

DOI:10.1021/jm00389a016

Reference yield:

2,4-dichlorophenylacetyl chloride (53056-20-5) → 1,2-Bis-(2,4-dichloro-phenyl)-propenone (104941-05-1)

Guidance literature:

Multi-step reaction with 2 steps

1: AlCl₃ / CS₂ / 0.5 h / Ambient temperature

2: 66 percent / Ac₂O / 0.5 h / 60 °C

With aluminium trichloride; acetic anhydride; In carbon disulfide;

DOI:10.1021/jm00391a037

Reference yield:

1,3-Dichlorobenzene (541-73-1) → 1,2-Bis-(2,4-dichloro-phenyl)-propenone (104941-05-1)

Guidance literature:

Multi-step reaction with 2 steps

1: AlCl₃ / CS₂ / 0.5 h / Ambient temperature

2: 66 percent / Ac₂O / 0.5 h / 60 °C

With aluminium trichloride; acetic anhydride; In carbon disulfide;

DOI:10.1021/jm00391a037

upstream raw materials:

bis-(dimethylamino)methane

2-(2,4-dichlorophenyl)-2',4'-dichloroacetophenone

1,3-Dichlorobenzene

2,4-dichlorophenylacetyl chloride

Downstream raw materials:

1,2-Bis-(2,4-dichloro-phenyl)-3-imidazol-1-yl-propan-1-one

2-(2,4-dichlorophenyl)-3-(1H-1,2,4-triazol-1-yl)-2',4'-dichloropropiophenone

(RS)-1,2-bis(2,4-dichlorophenyl)prop-2-en-1-ol

2-(2,4-dichlorobenzoyl)-2-(2,4-dichlorophenyl)oxirane