3-(3,4-Dichlorophenyl)propanamide

Base Information

• Chemical Name: 3-(3,4-Dichlorophenyl)propanamide
• CAS No.: 39960-04-8
• Molecular Formula: C₉H₉Cl₂NO
• Molecular Weight: 218.083
• DSSTox Substance ID: DTXSID001305811
• Mol file: 39960-04-8.mol

Synonyms:3-(3,4-dichlorophenyl)propanamide;3,4-dichloroBenzenepropanamide;39960-04-8;SCHEMBL3393678;MXJSTEGEEJRPOJ-UHFFFAOYSA-N;DTXSID001305811;AKOS022361102;3-(3,4-dichlorophenyl)propionic acid amide;FT-0715306;Z997948620

Chemical Property of 3-(3,4-Dichlorophenyl)propanamide

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 217.0061193
• Heavy Atom Count: 13
• Complexity: 187

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=C(C=C1CCC(=O)N)Cl)Cl

Technology Process of 3-(3,4-Dichlorophenyl)propanamide

There total 7 articles about 3-(3,4-Dichlorophenyl)propanamide 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: 96.0%

3(3,4-dichlorophenyl)propanoic acid (25173-68-6) → 3-(3,4-dichlorophenyl)propionamide (39960-04-8)

Guidance literature:

3(3,4-dichlorophenyl)propanoic acid; With oxalyl dichloride; N,N-dimethyl-formamide; In dichloromethane; at 0 - 20 ℃; for 3.5h;

With ammonium hydroxide; In diethyl ether; water; at 0 - 20 ℃; for 2h;

Reference yield: 96.0%

3-(3,4-dichlorophenyl)propionic acid chloride (90273-67-9) → 3-(3,4-dichlorophenyl)propionamide (39960-04-8)

Guidance literature:

With ammonium hydroxide; In diethyl ether; water; at 0 - 20 ℃; for 2.5h;

Reference yield: 59.0%

carbon monoxide (201230-82-2) + 3,4-dichlorostyrene (2039-83-0) → 3-(3,4-dichlorophenyl)propionamide (39960-04-8)

Guidance literature:

With dichloro bis(acetonitrile) palladium(II); ammonium chloride; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In 1-methyl-pyrrolidin-2-one; at 120 ℃; for 24h; under 7600.51 Torr; Autoclave;

upstream raw materials:

3(3,4-dichlorophenyl)propanoic acid

2-propenamide

1,2-dichloro-benzene

3,4-Dichlorocinnamic acid

Downstream raw materials:

3-(3,4-dichlorophenyl)propanenitrile

3-(3,4-dichlorophenyl)propan-1-amine

N-(3-(3,4-dichlorophenyl)propyl)-2-(4-(methylsulfonamido)phenoxy)acetamide

N-(3-(3,4-dichlorophenyl)propyl)-1-ethyl-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carboxamide