N-[4-(dimethylamino)phenyl]guanidine

Base Information

• Chemical Name: N-[4-(dimethylamino)phenyl]guanidine
• CAS No.: 67453-82-1
• Molecular Formula: C9H14N4
• Molecular Weight: 178.237
• DSSTox Substance ID: DTXSID80388656
• ChEMBL ID: CHEMBL231585
• Mol file: 67453-82-1.mol

Synonyms:N-[4-(dimethylamino)phenyl]guanidine;67453-82-1;2-[4-(dimethylamino)phenyl]guanidine;CHEMBL231585;SCHEMBL4154606;p-(Dimethylamino)phenylguanidine;NIOSH/MF0650000;DTXSID80388656;NAAHSJLHESEXLU-UHFFFAOYSA-N;1-(4-(dimethylamino)phenyl)guanidine;n-(4-dimethylamino-phenyl)-guanidine;AKOS005208322;Guanidine, N-(p-(dimethylamino)phenyl)-;LS-73581;CS-0300249;MF06500000;EN300-236144;F2158-0400

Chemical Property of N-[4-(dimethylamino)phenyl]guanidine

Chemical Property:

• PSA: 65.14000
• LogP: 1.93100
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 178.121846464
• Heavy Atom Count: 13
• Complexity: 176

Purity/Quality:

95% ^*data from raw suppliers

N-[4-(Dimethylamino)phenyl]guanidine ^*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)N=C(N)N

Technology Process of N-[4-(dimethylamino)phenyl]guanidine

There total 3 articles about N-[4-(dimethylamino)phenyl]guanidine 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: 65.0%

CYANAMID (420-04-2) + 4-amino-N,N-dimethylaniline (99-98-9) → 1-[4-(dimethylamino)phenyl]guanidine (67453-82-1)

Guidance literature:

With hydrogenchloride; In water; isopropyl alcohol; at 80 ℃; Inert atmosphere;

DOI:10.1016/j.ejmech.2018.08.043

Reference yield:

CYANAMID (420-04-2) → 1-[4-(dimethylamino)phenyl]guanidine (67453-82-1)

Guidance literature:

With ethanol;

Reference yield:

nitrosoguanidine (674-81-7) + 4-amino-N,N-dimethylaniline (99-98-9) → 1-[4-(dimethylamino)phenyl]guanidine (67453-82-1)

Guidance literature:

With water;

DOI:10.1021/ja01535a047

upstream raw materials:

nitrosoguanidine

4-amino-N,N-dimethylaniline

CYANAMID

Downstream raw materials:

2-amino-N-(4-(dimethylamino)phenyl)-4,5-dihydrothiazolo[4,5-h]quinazolin-8-amine

N-[4-(2,4-dimethyl-thiazol-5-yl)pyrimidin-2-yl]-N′,N′-dimethylbenzene-1,4-diamine

Refernces