Ethanone, 2-chloro-1-(2,4-dimethylphenyl)-

Base Information

• Chemical Name: Ethanone, 2-chloro-1-(2,4-dimethylphenyl)-
• CAS No.: 2623-45-2
• Molecular Formula: C10H11 Cl O
• Molecular Weight: 182.65
• Hs Code.: 2914700090
• NSC Number: 409123,1795
• DSSTox Substance ID: DTXSID4062563
• Nikkaji Number: J134.839F
• Wikidata: Q81990111
• Mol file: 2623-45-2.mol

Synonyms:2623-45-2;2-Chloro-1-(2,4-dimethylphenyl)ethanone;Ethanone, 2-chloro-1-(2,4-dimethylphenyl)-;2-Chloro-2',4'-dimethylacetophenone;NSC 1795;2-chloro-1-(2,4-dimethylphenyl)ethan-1-one;NSC 409123;Ethanone,4-dimethylphenyl)-;2,4-dimethylphenacyl chloride;SCHEMBL8420333;DTXSID4062563;NSC1795;NSC-1795;MFCD00152345;NSC409123;STK519635;AKOS000188096;NSC-409123;alpha-Chloro-2',4'-dimethylacetophenone;2-Chloro-1-(2,4-dimethylphenyl)ethanone #;CS-0239966;EN300-22190;J-016336;2-Chloro-1-(2,4-dimethylphenyl)ethanone, AldrichCPR;Z147641498

Chemical Property of Ethanone, 2-chloro-1-(2,4-dimethylphenyl)-

Chemical Property:

• Vapor Pressure: 0.00492mmHg at 25°C
• Melting Point: 62-63 °C
• Boiling Point: 276°Cat760mmHg
• Flash Point: 141.7°C
• PSA: 17.07000
• Density: 1.107g/cm³
• LogP: 2.72490
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 182.0498427
• Heavy Atom Count: 12
• Complexity: 167

Purity/Quality:

99% ^*data from raw suppliers

2-Chloro-1-(2,4-dimethylphenyl)ethanone Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)C(=O)CCl)C

Technology Process of Ethanone, 2-chloro-1-(2,4-dimethylphenyl)-

There total 7 articles about Ethanone, 2-chloro-1-(2,4-dimethylphenyl)- 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: 72.0%

chloroacetic acid (79-11-8) + m-xylene (108-38-3,104809-90-7) → 2-chloro-1-(2,4-dimethyl-phenyl)-ethanone (2623-45-2)

Guidance literature:

With P₂O₅/silica gel; for 2h; Reflux;

DOI:10.1016/j.tetlet.2008.09.062

Reference yield:

chloroacetyl chloride (79-04-9) + m-xylene (108-38-3,104809-90-7) → 2-chloro-1-(2,4-dimethyl-phenyl)-ethanone (2623-45-2)

Guidance literature:

With aluminium trichloride;

Reference yield:

2-oxo-2H-chromen-7-yl chloroethanoate (182115-37-3) + m-xylene (108-38-3,104809-90-7) → 2-chloro-1-(2,4-dimethyl-phenyl)-ethanone (2623-45-2) + dihydrofuro[2,3-h]coumarin-9-one (182115-42-0)

Guidance literature:

With aluminium trichloride; at 140 ℃; for 0.5h;

upstream raw materials:

1-iodoethynyl-2,4-dimethyl-benzene

chloroacetyl chloride

m-xylene

2-oxo-2H-chromen-7-yl chloroethanoate

Downstream raw materials:

1-(2,4-dimethyl-phenacyl)-3-hydroxy-pyridinium; chloride

5-bromo-2,4-dimethylbenzoic acid

2-(2,4-dimethylphenyl)-2-oxoethyl acetate

2-(benzo[d]thiazol-2-ylthio)-1-(2,4-dimethylphenyl)ethanone