4-(2-aminoethyl)-N,N-dimethylaniline

Base Information

• Chemical Name: 4-(2-aminoethyl)-N,N-dimethylaniline
• CAS No.: 5636-52-2
• Molecular Formula: C10H16 N2
• Molecular Weight: 164.25
• Hs Code.: 2921590090
• European Community (EC) Number: 684-491-2
• UNII: Q37PYH7D9X
• DSSTox Substance ID: DTXSID60967069
• Nikkaji Number: J580.425F
• Wikidata: Q82949571
• Mol file: 5636-52-2.mol

Synonyms:4-dimethylaminophenethylamine;4-N,N-dimethylaminophenethylamine;DMAPEA

Chemical Property of 4-(2-aminoethyl)-N,N-dimethylaniline

Chemical Property:

• Vapor Pressure: 0.00499mmHg at 25°C
• Boiling Point: 275.8°Cat760mmHg
• Flash Point: 108.3°C
• PSA: 29.26000
• Density: 1.002g/cm³
• LogP: 1.95410
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 164.131348519
• Heavy Atom Count: 12
• Complexity: 115

Purity/Quality:

98%min ^*data from raw suppliers

4-[2-(Dimethylamino)ethyl]aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=C(C=C1)CCN

Technology Process of 4-(2-aminoethyl)-N,N-dimethylaniline

There total 14 articles about 4-(2-aminoethyl)-N,N-dimethylaniline 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: 86.0%

N,N-dimethyl-2-(4-nitrophenyl)ethanamine (5339-05-9) → 4-[2-(dimethylamino)ethyl]aniline (5636-52-2)

Guidance literature:

With palladium on activated charcoal; hydrogen; In methanol; for 16h; under 2327.23 Torr;

Reference yield: 45.0%

p-Aminophenethylamine (13472-00-9) + carbonic acid dimethyl ester (616-38-6) → 4-(2-Methylamino-ethyl)-phenylamine (32868-32-9) + 4-[2-(dimethylamino)ethyl]aniline (5636-52-2) + 2-4-aminophenylethylcarbamic acid methyl ester (144222-20-8)

Guidance literature:

With carbon dioxide; at 130 ℃; for 17h; under 67505.4 Torr;

DOI:10.1021/jo0477796

Reference yield:

tert-butyl N-{4-[2-(dimethylamino)-2-oxoethyl]phenyl}carbamate (882873-15-6) → 4-[2-(dimethylamino)ethyl]aniline (5636-52-2)

Guidance literature:

tert-butyl N-{4-[2-(dimethylamino)-2-oxoethyl]phenyl}carbamate; With trifluoroacetic acid; at 20 ℃; for 0.5h;

With sodium hydroxide; In water; at 0 ℃;

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 70 ℃; for 0.5h;

upstream raw materials:

N,N-dimethyl-2-(4-nitrophenyl)acetamide

N,N-dimethyl-2-(4-nitrophenyl)ethanamine

2-(4-Aminophenyl)N,N-dimethylacetamide

N,N-dimethyl-2-(4-nitrophenyl)ethanethioamide

Downstream raw materials:

C₂₉H₃₁N₅O₃

Refernces

• 1、 -. "WEE1 KINASE INHIBITORS AND METHODS OF TREATING CANCER USING THE SAME". Page/Page column 50. . Retrieved 2019/09/18.
• 2、 -. "8-ETHYL-6-(ARYL)PYRIDO [2,3-D]PYRIMIDIN-7(8H) -ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER". Paragraph 00596. . Retrieved 2013/04/10.