N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine

Base Information

• Chemical Name: N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine
• CAS No.: 84434-83-3
• Molecular Formula: C13H21ClN2
• Molecular Weight: 240.776
• NSC Number: 165828
• DSSTox Substance ID: DTXSID60304455
• Wikidata: Q82050373
• Mol file: 84434-83-3.mol

Synonyms:84434-83-3;N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine;[(4-chlorophenyl)methyl][2-(diethylamino)ethyl]amine;N1-(4-chlorobenzyl)-N2,N2-diethylethane-1,2-diamine;NSC165828;SCHEMBL1724753;DTXSID60304455;QMHPWYDPGOPWPA-UHFFFAOYSA-N;AKOS000236784;NSC-165828;SB81216;CS-0242731;EN300-254381;N'-(4-CHLOROBENZYL)-N,N-DIETHYLETHYLENEDIAMINE

Chemical Property of N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine

Chemical Property:

• Boiling Point: 319.2°Cat760mmHg
• Flash Point: 146.9°C
• Density: 1.034g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 240.1393264
• Heavy Atom Count: 16
• Complexity: 163

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN(CC)CCNCC1=CC=C(C=C1)Cl

Technology Process of N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-1,2-diamine

There total 3 articles about N-[(4-chlorophenyl)methyl]-N',N'-diethylethane-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:

2-bromo-N,N-diethylethanamine hydrobromide (1069-72-3) + 4-chlorobenzylamine (104-86-9) → N1-(4-chlorobenzyl)-N2,N2-diethylethane-1,2-diamine (84434-83-3)

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃; for 5h;

Reference yield:

4-chlorobenzaldehyde (104-88-1) + N,N-diethylethylenediamine (100-36-7) → N1-(4-chlorobenzyl)-N2,N2-diethylethane-1,2-diamine (84434-83-3)

Guidance literature:

Multistep reaction; (i) , (ii) HCO₂H, Et₃N, (iii) (heating);

DOI:10.1039/jr9610001908

Reference yield:

→ N1-(4-chlorobenzyl)-N2,N2-diethylethane-1,2-diamine (84434-83-3)

Guidance literature:

Entspr. N-Formyl-Verb., HCl;

upstream raw materials:

4-chlorobenzaldehyde

N,N-diethylethylenediamine

2-bromo-N,N-diethylethanamine hydrobromide

4-chlorobenzylamine

Downstream raw materials:

N'.N'-Diaethyl-N-<4-chlor-benzyl>-N-fluorenyl-(9)-aethylendiamin

tert-butyl 4-(N-(4-chlorobenzyl)-N-(2-(diethylamino)ethyl)carbamoyl)piperazine-1-carboxylate