Benzonitrile, 2-[(1,3-dihydro-1-imino-2H-isoindol-2-yl)methyl]-, monohydrochloride

Base Information

• Chemical Name: Benzonitrile, 2-[(1,3-dihydro-1-imino-2H-isoindol-2-yl)methyl]-, monohydrochloride
• CAS No.: 97934-35-5
• Molecular Formula: C₁₆H₁₃N₃*ClH
• Molecular Weight: 283.76
• Mol file: 97934-35-5.mol

Synonyms:2-(1-Imino-1,3-dihydro-isoindol-2-ylmethyl)-benzonitrile;hydrochloride;

Chemical Property of Benzonitrile, 2-[(1,3-dihydro-1-imino-2H-isoindol-2-yl)methyl]-, monohydrochloride

Chemical Property:

• PSA: 50.88000
• LogP: 3.73908

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzonitrile, 2-[(1,3-dihydro-1-imino-2H-isoindol-2-yl)methyl]-, monohydrochloride

There total 1 articles about Benzonitrile, 2-[(1,3-dihydro-1-imino-2H-isoindol-2-yl)methyl]-, monohydrochloride 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:

1-aminoisoindole hydrochloride (22780-52-5) + 2-cyanobenzyl chloride (612-13-5) → hydrochloride of 2-(o-cyanobenzyl)-1-imino-3H-isoindole (97934-35-5)

Guidance literature:

In methanol;

DOI:10.1007/BF00506081

Reference yield:

hydrochloride of 2-(o-cyanobenzyl)-1-imino-3H-isoindole (97934-35-5) → 1-[11H,13H-Benzo[5,6][1,3]diazepino[2,1-a]isoindol-(6E)-ylidene]-3-phenyl-urea (97934-38-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 68 percent / CH₃CH₂ONa / ethanol / 5 h / Heating

With C₂H₆O*Na⁽¹⁺⁾; In ethanol;

DOI:10.1007/BF00506081

Reference yield:

hydrochloride of 2-(o-cyanobenzyl)-1-imino-3H-isoindole (97934-35-5) → 1-[11H,13H-Benzo[5,6][1,3]diazepino[2,1-a]isoindol-(6E)-ylidene]-3-phenyl-thiourea (97934-39-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 68 percent / CH₃CH₂ONa / ethanol / 5 h / Heating

With C₂H₆O*Na⁽¹⁺⁾; In ethanol;

DOI:10.1007/BF00506081

upstream raw materials:

1-aminoisoindole hydrochloride

2-cyanobenzyl chloride

Downstream raw materials:

1-[11H,13H-Benzo[5,6][1,3]diazepino[2,1-a]isoindol-(6E)-ylidene]-3-phenyl-urea

1-[11H,13H-Benzo[5,6][1,3]diazepino[2,1-a]isoindol-(6E)-ylidene]-3-phenyl-thiourea