N-Benzyl-N'-methylethylenediamine

Base Information

• Chemical Name: N-Benzyl-N'-methylethylenediamine
• CAS No.: 56904-09-7
• Molecular Formula: C10H16N2
• Molecular Weight: 164.24744
• Hs Code.: 2921590090
• DSSTox Substance ID: DTXSID20448329
• Mol file: 56904-09-7.mol

Synonyms:56904-09-7;benzyl[2-(methylamino)ethyl]amine;N-BENZYL-N'-METHYLETHYLENEDIAMINE;N-benzyl-N'-methylethane-1,2-diamine;N'-benzyl-N-methylethane-1,2-diamine;F2147-1245;n-benzyl-n-methylethylenediamine;SCHEMBL3257144;DTXSID20448329;HUQLOABSMDKQBW-UHFFFAOYSA-N;benzyl-(2-methylamino-ethyl)-amine;AB2659;MFCD09037852;AKOS005306451;SB76368;N'-benzyl-N-methyl-ethane-1,2-diamine;CS-0250391;FT-0693714;EN300-50645;N(1)-benzyl-N(2)-methyl-1,2-ethanediamine;N~1~-Benzyl-N~2~-methylethane-1,2-diamine;AB01000161-01;A831227;Z425484772

Chemical Property of N-Benzyl-N'-methylethylenediamine

Chemical Property:

• PSA: 24.06000
• LogP: 1.77740
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 164.131348519
• Heavy Atom Count: 12
• Complexity: 98

Purity/Quality:

98% ^*data from raw suppliers

N-Benzyl-N''-methylethylenediamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CNCCNCC1=CC=CC=C1

Technology Process of N-Benzyl-N'-methylethylenediamine

There total 5 articles about N-Benzyl-N'-methylethylenediamine 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: 66.0%

N-Benzyl-N'-methyloxamide (7666-51-5) → N-methyl-2-(benzylamino)ethylamine (56904-09-7)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 16h; Heating;

DOI:10.1055/s-1986-31737

Reference yield: 63.0%

3-benzylhydantoin (2301-40-8) → N-methyl-2-(benzylamino)ethylamine (56904-09-7)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 72h; Heating; Argon;

DOI:10.1021/jo00161a021

Reference yield:

N-benzyloxamic acid ethyl ester (7142-72-5) → N-methyl-2-(benzylamino)ethylamine (56904-09-7)

Guidance literature:

Multi-step reaction with 2 steps

1: 97 percent / ethanol / 3 h

2: 66 percent / lithium aluminum hydride / tetrahydrofuran / 16 h / Heating

With lithium aluminium tetrahydride; In tetrahydrofuran; ethanol;

DOI:10.1055/s-1986-31737

upstream raw materials:

3-benzylhydantoin

N-Benzyl-N'-methyloxamide

N-benzyloxamic acid ethyl ester

benzylamine

Downstream raw materials:

1-Benzyl-3-methyl-1,3-diazolidine

1-benzyl-3-methyl-2-nonyl-2,3,4,5-tetrahydroimidazole

methyl 2-acetylamino-3-propionate

1-benzyl-4-methylhexahydro-1H-1,4-diazepine-6-carboxylic acid

Refernces

• 1、 Cortes, Sergio,Kohn, Harold. "Selective Reductions of 3-Substituted Hydantoins to 4-Hydroxy-2-imidazolidinones and Vicinal Diamines". . p. 2246 - 2254. Retrieved 2007/10/02.