Tolonidine

Base Information

• Chemical Name: Tolonidine
• CAS No.: 4201-22-3
• Molecular Formula: C10H12 Cl N3
• Molecular Weight: 209.678
• Hs Code.: 2933290090
• UNII: I4O795Q03O
• DSSTox Substance ID: DTXSID80194815
• Nikkaji Number: J9.617B
• Wikipedia: Tolonidine
• Wikidata: Q6590380
• NCI Thesaurus Code: C75048
• Metabolomics Workbench ID: 154239
• ChEMBL ID: CHEMBL304253
• Mol file: 4201-22-3.mol

Synonyms:2-(2-chloro-p-toluidino)-2-imidazoline nitrate;tolonidine;tolonidine monohydrochloride;tolonidine mononitrate;tolonidine nitrate

Chemical Property of Tolonidine

Chemical Property:

• Vapor Pressure: 0.000478mmHg at 25°C
• Melting Point: 148-150°
• Boiling Point: 314°C at 760 mmHg
• PKA: 9.41(at 25℃)
• Flash Point: 143.7°C
• PSA: 36.42000
• Density: 1.31g/cm³
• LogP: 1.85690
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 209.0719751
• Heavy Atom Count: 14
• Complexity: 229

Purity/Quality:

99% ^*data from raw suppliers

TOLONIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)NC2=NCCN2)Cl
• Therapeutic Function: Antihypertensive

Technology Process of Tolonidine

There total 4 articles about Tolonidine 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-chloro-4-methyl-phenyl)-(4,5-dihydro-1H-imidazol-2-yl)-prop-2-ynyl-amine (61939-92-2) → propargyl bromide (106-96-7) + Tolonidine (4201-22-3)

Guidance literature:

Reference yield:

2-chloro-4-methylphenylcarbonimidoyl dichloride (41062-11-7) → 2-(2-chloro-4-methyl-phenylimino)-imidazolidine (4201-22-3)

Guidance literature:

With ethylenediamine; triethylamine; In ethyl acetate;

Reference yield:

→ 2-(2-chloro-4-methyl-phenylimino)-imidazolidine (4201-22-3)

Guidance literature:

upstream raw materials:

2-chloro-4-methylphenylcarbonimidoyl dichloride

(2-chloro-4-methyl-phenyl)-(4,5-dihydro-1H-imidazol-2-yl)-prop-2-ynyl-amine

Downstream raw materials:

(2,5-dichloro-4-methyl-phenyl)-(4,5-dihydro-1H-imidazol-2-yl)-amine

Refernces

• 1、 -. "Method of lowering intraocular pressure using phenylimino-imidazoles". . . Retrieved 2008/06/13.
• 2、 -. "Compounds, compositions and methods for controlling pests". . . Retrieved 2008/06/13.