2-(Dimethylamino)acetyl chloride

Base Information

• Chemical Name: 2-(Dimethylamino)acetyl chloride
• CAS No.: 51552-16-0
• Molecular Formula: C4H8ClNO
• Molecular Weight: 121.567
• DSSTox Substance ID: DTXSID90426634
• Nikkaji Number: J1.572.987B
• Wikidata: Q72468815
• Mol file: 51552-16-0.mol

Synonyms:2-(dimethylamino)acetyl chloride;51552-16-0;(DIMETHYLAMINO)ACETYL CHLORIDE;dimethylaminoacetyl chloride;dimethylamino-acetyl chloride;SCHEMBL103364;N,N-dimethylaminoacetyl chloride;DTXSID90426634;2-(dimethylamino) acetyl chloride;VTYRPALGSNDUQQ-UHFFFAOYSA-N;2-(N,N-dimethylamino)-acetylchloride;EN300-198477

Chemical Property of 2-(Dimethylamino)acetyl chloride

Chemical Property:

• Melting Point: 110-113 °C
• Boiling Point: 114.8 °C at 760 mmHg
• PKA: 6.79±0.28(Predicted)
• Flash Point: 23.2 °C
• PSA: 20.31000
• Density: 1.101 g/cm³
• LogP: 0.31340
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 121.0294416
• Heavy Atom Count: 7
• Complexity: 72.1

Purity/Quality:

99% ^*data from raw suppliers

N,N-DimethylaminoacetylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC(=O)Cl
• Uses: N,N-Dimethylaminoacetyl Chloride is used as a reagent in the discovery of novel amino-pyrimidine inhibitors of insulin-like growth factor1 and insulin receptors kinase through parallel optimization of cell potency and hERG inhibition.

Technology Process of 2-(Dimethylamino)acetyl chloride

There total 3 articles about 2-(Dimethylamino)acetyl chloride 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:

dimethylaminoacetic acid (1118-68-9) → dimethylaminoacetyl chloride (51552-16-0)

Guidance literature:

With thionyl chloride;

DOI:10.1016/j.bmcl.2004.04.065

Reference yield:

N,N-dimethylglycine hydrochoride (2491-06-7) → dimethylaminoacetyl chloride (51552-16-0)

Guidance literature:

With phosphorus pentachloride; acetyl chloride;

DOI:10.1007/BF00761341

Reference yield:

→ dimethylaminoacetyl chloride (51552-16-0)

Guidance literature:

upstream raw materials:

N,N-dimethylglycine hydrochoride

dimethylaminoacetic acid

Downstream raw materials:

5-dimethylamino-2-methylsulfanyl-3-p-tolylpyrimidin-4(3H)-one

2-(dimethylamino)-1-(4-(((3-(3-(trifluoromethoxy)phenyl)imidazo[1,2-b]pyridazin-6-yl)amino)methyl)piperidin-1-yl)ethanone

10-(2-(dimethylamino)acetamido)-N-(4-fluorobenzyl)-3-hydroxy-4-oxo-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxamide

Refernces

• 1、 Vasil'eva,Z.A.,Petrun'kin,V.E.. "-". . . Retrieved 1969.
• 2、 -. "IMPROVED COMPOSITIONS AND METHODS FOR THE DELIVERY OF NUCLEIC ACIDS". Paragraph 0244;0247. . Retrieved 2016/08/17.
• 3、 Grosjean, Sylvain,Triki, Smail,Meslin, Jean-Claude,Julienne, Karine,Deniaud, David. "Synthesis of nitrogen bicyclic scaffolds: Pyrimido[1,2-a]pyrimidine-2,6- diones". experimental part. p. 9912 - 9924. Retrieved 2011/02/22.