Cycloheptanepropanenitrile

Base Information

• Chemical Name: Cycloheptanepropanenitrile
• CAS No.: 4448-80-0
• Molecular Formula: C10H17N
• Mol file: 4448-80-0.mol

Synonyms:

Chemical Property of Cycloheptanepropanenitrile

Chemical Property:

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Cycloheptanepropanenitrile

There total 1 articles about Cycloheptanepropanenitrile 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: 50.0%

benzophenone (119-61-9) + cycloheptane (291-64-5) + acrylonitrile (107-13-1,25014-41-9) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → Cycloheptyl-diphenyl-carbinol (24632-13-1) + phenylcycloheptane (4401-18-7) + 3-cycloheptylpropionitrile (4448-80-0)

Guidance literature:

for 15h; Irradiation;

DOI:10.1021/jo010400k

Reference yield: 16.7%

3-cycloheptylpropionitrile (4448-80-0) + thiosemicarbazide (79-19-6) → 5-(2-Cycloheptyl-ethyl)-[1,3,4]thiadiazol-2-ylamine (118313-96-5) + 5-[2-(4-Methyl-cyclohexyl)-ethyl]-[1,3,4]thiadiazol-2-ylamine (118313-98-7)

Guidance literature:

With trifluoroacetic acid;

DOI:10.1248/cpb.40.2391

Reference yield:

3-cycloheptylpropionitrile (4448-80-0) → 3-(3-Benzoyl-thioureido)-4-cycloheptylmethyl-1H-pyrrole-2-carboxylic acid methyl ester (135197-56-7)

Guidance literature:

Multi-step reaction with 5 steps

1: NaH / tetrahydrofuran / 72 h / 55 °C

2: NaOAc / methanol; H₂O / 24 h / Ambient temperature

3: 1,5-diazabicyclo<4.3.0>non-5-ene (DBN) / CH₂Cl₂ / 0 - 20 °C

4: Na₂CO₃ / methanol / 48 h / Ambient temperature

5: CH₂Cl₂ / 1 h / Ambient temperature

With DBN; sodium acetate; sodium hydride; sodium carbonate; In tetrahydrofuran; methanol; dichloromethane; water;

DOI:10.1021/jm00065a007

upstream raw materials:

benzophenone

cycloheptane

acrylonitrile

benzene

Downstream raw materials:

5-(2-Cycloheptyl-ethyl)-[1,3,4]thiadiazol-2-ylamine

5-[2-(4-Methyl-cyclohexyl)-ethyl]-[1,3,4]thiadiazol-2-ylamine

3-(3-Benzoyl-2-methyl-isothioureido)-4-cycloheptylmethyl-1H-pyrrole-2-carboxylic acid methyl ester

3-(3-Benzoyl-thioureido)-4-cycloheptylmethyl-1H-pyrrole-2-carboxylic acid methyl ester

Refernces