3-Chloro-N-(2-propyn-1-YL)propionamide

Base Information

• Chemical Name: 3-Chloro-N-(2-propyn-1-YL)propionamide
• CAS No.: 42275-96-7
• Molecular Formula: C₆H₈ClNO
• Molecular Weight: 145.589
• European Community (EC) Number: 662-496-0
• Mol file: 42275-96-7.mol

Synonyms:3-CHLORO-N-(2-PROPYN-1-YL)PROPIONAMIDE;AKOS000183784

Chemical Property of 3-Chloro-N-(2-propyn-1-YL)propionamide

Chemical Property:

• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 145.0294416
• Heavy Atom Count: 9
• Complexity: 135

Purity/Quality:

97% ^*data from raw suppliers

3-CHLORO-N-(2-PROPYN-1-YL)PROPIONAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C#CCNC(=O)CCCl

Technology Process of 3-Chloro-N-(2-propyn-1-YL)propionamide

There total 2 articles about 3-Chloro-N-(2-propyn-1-YL)propionamide 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: 92.0%

2-chloropropionyl chloride (625-36-5) + Propargylamine (2450-71-7) → 3-chloro-propionic acid prop-2-ynylamide (42275-96-7)

Guidance literature:

With triethylamine; In tetrahydrofuran; at 0 - 20 ℃; for 2.75h; Inert atmosphere;

DOI:10.1016/j.bmc.2016.04.021

Reference yield:

prop-2-yn-1-amine hydrochloride (15430-52-1) + 2-chloropropionyl chloride (625-36-5) → 3-chloro-propionic acid prop-2-ynylamide (42275-96-7)

Guidance literature:

With sodium hydroxide; diethyl ether;

upstream raw materials:

prop-2-yn-1-amine hydrochloride

2-chloropropionyl chloride

Propargylamine