1,3-Dimethyl-1,3-diphenylguanidine

Base Information

• Chemical Name: 1,3-Dimethyl-1,3-diphenylguanidine
• CAS No.: 46893-81-6
• Molecular Formula: C15H17N3
• Molecular Weight: 239.32
• DSSTox Substance ID: DTXSID901023612
• Nikkaji Number: J733.875I
• Mol file: 46893-81-6.mol

Synonyms:SCHEMBL10641896;DTXSID901023612;1,3-Dimethyl-1,3-diphenylguanidine;N,N'-Dimethyl-N,N'-diphenylguanidine;46893-81-6

Chemical Property of 1,3-Dimethyl-1,3-diphenylguanidine

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 239.142247555
• Heavy Atom Count: 18
• Complexity: 239

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C1=CC=CC=C1)C(=N)N(C)C2=CC=CC=C2

Technology Process of 1,3-Dimethyl-1,3-diphenylguanidine

There total 3 articles about 1,3-Dimethyl-1,3-diphenylguanidine 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: 70.0%

N-methylaniline (100-61-8) + N-methyl-N-phenyl-imidazole-1-carboxamidine (477482-02-3) → N,N'-dimethyl-N,N'-diphenylguanidine (46893-81-6)

Guidance literature:

In N,N-dimethyl-formamide; at 90 ℃; for 18h;

DOI:10.1021/jo0202381

Reference yield:

methyl(phenyl)cyanamide (18773-77-8) + N-methylaniline hydrochloride (2739-12-0) → N,N'-dimethyl-N,N'-diphenylguanidine (46893-81-6)

Guidance literature:

at 180 - 190 ℃;

DOI:10.1246/bcsj.47.935

Reference yield:

→ N,N'-dimethyl-N,N'-diphenylguanidine (46893-81-6)

Guidance literature:

DOI:10.1139/v71-374

upstream raw materials:

methyl(phenyl)cyanamide

N-methylaniline hydrochloride

N-methylaniline

N-methyl-N-phenyl-imidazole-1-carboxamidine

Downstream raw materials:

1,3-dimethyl-1,3-diphenylurea

2,3-diethyl-1-methyl-1H-indole