N'-(4-chloro-2-nitrophenyl)-N,N-dimethylethane-1,2-diamine

Base Information

• Chemical Name: N'-(4-chloro-2-nitrophenyl)-N,N-dimethylethane-1,2-diamine
• CAS No.: 4926-56-1
• Molecular Formula: C₁₀H₁₄ClN₃O₂
• Molecular Weight: 243.693
• DSSTox Substance ID: DTXSID201183873
• ChEMBL ID: CHEMBL1500490

Synonyms:N'-(4-chloro-2-nitrophenyl)-N,N-dimethylethane-1,2-diamine;SMR000207317;CBMicro_009218;Oprea1_695294;MLS000584932;CHEMBL1500490;DTXSID201183873;HMS2573J13;SMSF0003682;STK036296;AKOS001724337;4926-56-1;N-[2-(4-chloro-2-nitroanilino)ethyl]-N,N-dimethylamine;N2-(4-Chloro-2-nitrophenyl)-N1,N1-dimethyl-1,2-ethanediamine

Chemical Property of N'-(4-chloro-2-nitrophenyl)-N,N-dimethylethane-1,2-diamine

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 243.0774544
• Heavy Atom Count: 16
• Complexity: 233

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(C)CCNC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Technology Process of N'-(4-chloro-2-nitrophenyl)-N,N-dimethylethane-1,2-diamine

There total 3 articles about N'-(4-chloro-2-nitrophenyl)-N,N-dimethylethane-1,2-diamine 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: 53.0%

N,N-dimethylethylenediamine (108-00-9) + 2,5-dichloronitrobenzene (89-61-2) → N1-(4-chloro-2-nitrophenyl)-N2,N2-dimethylethane-1,2-diamine (4926-56-1)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; isopropyl alcohol; at 90 - 100 ℃; for 24h;

DOI:10.3390/molecules26144200

Reference yield:

N,N-diethylethylenediamine (100-36-7) + 2,5-dichloronitrobenzene (89-61-2) → N1-(4-chloro-2-nitrophenyl)-N2,N2-dimethylethane-1,2-diamine (4926-56-1)

Guidance literature:

In N,N-dimethyl-formamide; at 80 ℃;

DOI:10.1021/ml300282t

Reference yield:

→ N1-(4-chloro-2-nitrophenyl)-N2,N2-dimethylethane-1,2-diamine (4926-56-1)

Guidance literature:

analog Kremer (Am. Soc. 59 <1937> 1681);

upstream raw materials:

N,N-diethylethylenediamine

2,5-dichloronitrobenzene

N,N-dimethylethylenediamine

Downstream raw materials:

2-[5-chloro-2-(2-methoxyphenyl)-1H-benzo[d]imidazol-1-yl]-N,N-diethylethanamine

2-[5-chloro-2-(5-methylthiophen-2-yl)-1H-benzo[d]imidazol-1-yl]-N,N-diethylethanamine

7-cloro-4-fenil-1-<(dimetilammino)etil>-1,3-diidro-2H-1,5-benzodiazepin-2-one

1-Chlor-3-amino-4-(2-dimethylamino-aethylamino)-benzol

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