3,4-Dichloro-N-(2-chloroethyl)benzamide

Base Information

• Chemical Name: 3,4-Dichloro-N-(2-chloroethyl)benzamide
• CAS No.: 15317-17-6
• Molecular Formula: C₉H₈Cl₃NO
• Molecular Weight: 252.528
• NSC Number: 96320
• DSSTox Substance ID: DTXSID70165236
• Wikidata: Q83034373
• Mol file: 15317-17-6.mol

Synonyms:3,4-Dichloro-N-(2-chloroethyl)benzamide;15317-17-6;NSC96320;NSC 96320;DTXSID70165236;NSC-96320;AKOS010542492

Chemical Property of 3,4-Dichloro-N-(2-chloroethyl)benzamide

Chemical Property:

• Vapor Pressure: 1.89E-05mmHg at 25°C
• Boiling Point: 362.7°C at 760 mmHg
• Flash Point: 173.2°C
• Density: 1.39g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 250.967147
• Heavy Atom Count: 14
• Complexity: 201

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C(=O)NCCCl)Cl)Cl

Technology Process of 3,4-Dichloro-N-(2-chloroethyl)benzamide

There total 2 articles about 3,4-Dichloro-N-(2-chloroethyl)benzamide 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:

3,4-Dichlor-benzoesaeure-(2-hydroxy-ethylamid) (28298-26-2) → N-(2-Chloroethyl)-3,4-dichlorobenzamide (15317-17-6)

Guidance literature:

With thionyl chloride; In chloroform; for 0.5h; Heating;

DOI:10.1021/jo00143a029

Reference yield:

3,4-dichlorobenzoyl chloride (3024-72-4) → N-(2-Chloroethyl)-3,4-dichlorobenzamide (15317-17-6)

Guidance literature:

Multi-step reaction with 2 steps

1: CH₂Cl₂ / 1.) 5 deg C, 2.) RT, 0.5 h

2: thionyl chloride / CHCl₃ / 0.5 h / Heating

With thionyl chloride; In dichloromethane; chloroform;

DOI:10.1021/jo00143a029

Reference yield:

N-(2-Chloroethyl)-3,4-dichlorobenzamide (15317-17-6) → 2-(3,4-dichlorophenyl)-4,5-dihydrooxazole (82891-87-0)

Guidance literature:

With sodium hydride; In tetrahydrofuran; for 0.5h; Heating;

DOI:10.1021/jo00143a029

upstream raw materials:

3,4-Dichlor-benzoesaeure-(2-hydroxy-ethylamid)

3,4-dichlorobenzoyl chloride

Downstream raw materials:

2-(3,4-dichlorophenyl)-4,5-dihydrooxazole