4-(cyclopropylamino)benzonitrile

Base Information

• Chemical Name: 4-(cyclopropylamino)benzonitrile
• CAS No.: 1019607-55-6
• Molecular Formula: C10H10N2
• Molecular Weight: 158.203
• Hs Code.: 2926909090
• Mol file: 1019607-55-6.mol

Synonyms:4-(cyclopropylamino)benzonitrile

Chemical Property of 4-(cyclopropylamino)benzonitrile

Chemical Property:

• Boiling Point: 321.6±25.0 °C(Predicted)
• PKA: 5.41±0.20(Predicted)
• PSA: 35.82000
• Density: 1.13±0.1 g/cm3(Predicted)
• LogP: 2.20558

Purity/Quality:

97% ^*data from raw suppliers

4-(Cyclopropylamino)benzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(cyclopropylamino)benzonitrile

There total 3 articles about 4-(cyclopropylamino)benzonitrile 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: 89.0%

4-Cyanochlorobenzene (623-03-0) + Cyclopropylamine (765-30-0) → 4-(cyclopropylamino)benzonitrile (1019607-55-6)

Guidance literature:

With C₃₅H₄₉ClNiO₃P₂; sodium t-butanolate; In toluene; at 25 ℃; for 16h; Inert atmosphere; Glovebox; Sealed tube;

DOI:10.1021/acscatal.7b02014

Reference yield: 53.0%

4-bromobenzenecarbonitrile (623-00-7) + Cyclopropylamine (765-30-0) → 4-(cyclopropylamino)benzonitrile (1019607-55-6)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; sodium tert-pentoxide; (R)-tol-BINAP; In toluene; at 80 ℃; for 18h; Sealed tube; Glovebox;

DOI:10.3762/bjoc.10.96

Reference yield: 50.0%

4-fluorobenzonitrile (1194-02-1,143234-87-1) + Cyclopropylamine (765-30-0) → 4-(cyclopropylamino)benzonitrile (1019607-55-6)

Guidance literature:

With potassium carbonate; In dimethyl sulfoxide; at 120 ℃; for 1.5h; Microwave irradiation;

upstream raw materials:

4-bromobenzenecarbonitrile

Cyclopropylamine

4-fluorobenzonitrile

4-Cyanochlorobenzene

Downstream raw materials:

C₁₈H₁₆N₂

C₁₄H₁₄N₂O₂

3-bromo-N-(4-cyanophenyl)-N-cyclopropylpyrazolo[1,5-a]pyridine-5-carboxamide

N-(4-cyanophenyl)-N-cyclopropyl-3-(5-(methylcarbamoyl)pyridin-2-yl)pyrazolo[1,5-a]pyridine-5-carboxamide

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