N-Benzyl-N-Methylguanidine

Base Information

• Chemical Name: N-Benzyl-N-Methylguanidine
• CAS No.: 7565-19-7
• Molecular Formula: C9H13N3
• Molecular Weight: 163.22
• Hs Code.: 2925290090
• DSSTox Substance ID: DTXSID10274497
• Nikkaji Number: J965.544A
• Wikidata: Q82003849
• Mol file: 7565-19-7.mol

Synonyms:N-Benzyl-N-Methylguanidine;1-benzyl-1-methylguanidine;7565-19-7;CHEMBRDG-BB 4015994;330-69-8;methyl-benzylguanidine;SCHEMBL1620582;DTXSID10274497;STL185722;AKOS000225158;BS-3881;BB 0323263;FT-0767841

Chemical Property of N-Benzyl-N-Methylguanidine

Chemical Property:

• Vapor Pressure: 0.00699mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 270.1°C at 760 mmHg
• Flash Point: 117.1°C
• PSA: 53.11000
• Density: 1.07g/cm³
• LogP: 1.81190
• Storage Temp.: 2-8°C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 163.110947427
• Heavy Atom Count: 12
• Complexity: 150

Purity/Quality:

99% ^*data from raw suppliers

N-Benzyl-N-methylguanidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(CC1=CC=CC=C1)C(=N)N

Technology Process of N-Benzyl-N-Methylguanidine

There total 5 articles about N-Benzyl-N-Methylguanidine 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: 88.0%

benzyl-methyl-amine (103-67-3) + 4-benzyl-3,5-dimethyl-1H-pyrazole-1-carboximidamide hydrochloride → N-benzyl-N-methylguanidine (7565-19-7)

Guidance literature:

With triethylamine; In acetonitrile; at 60 ℃; for 24h;

DOI:10.1016/S0040-4039(01)02403-0 DOI:10.1055/s-2006-926284

Reference yield:

carbamimidothioic acid methyl ester (2986-19-8) + benzyl-methyl-amine (103-67-3) → N-benzyl-N-methylguanidine (7565-19-7)

Guidance literature:

Reference yield:

thiourea (17356-08-0) + benzyl-methyl-amine (103-67-3) → N-benzyl-N-methylguanidine (7565-19-7)

Guidance literature:

Yield given. Multistep reaction; solid-phase synthesis;

DOI:10.1016/S0040-4039(98)01242-8

upstream raw materials:

carbamimidothioic acid methyl ester

benzyl-methyl-amine

CYANAMID

N-methylbenzylamine hydrochloride