N-(3-cyanophenyl)-2-methylpropanamide

Base Information

• Chemical Name: N-(3-cyanophenyl)-2-methylpropanamide
• CAS No.: 900710-59-0
• Molecular Formula: C₁₁H₁₂N₂O
• Molecular Weight: 188.229
• European Community (EC) Number: 868-087-5
• Mol file: 900710-59-0.mol

Synonyms:N-(3-cyanophenyl)-2-methylpropanamide;900710-59-0;N-(3-cyanophenyl)isobutyramide;SCHEMBL4599032;JWBISRKEEZGPFB-UHFFFAOYSA-N;AKOS000199815;CS-0244673;EN300-28807;Z26548083;WL4

Chemical Property of N-(3-cyanophenyl)-2-methylpropanamide

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 188.094963011
• Heavy Atom Count: 14
• Complexity: 251

Purity/Quality:

97% ^*data from raw suppliers

N-(3-cyanophenyl)-2-methylpropanamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)C(=O)NC1=CC=CC(=C1)C#N

Technology Process of N-(3-cyanophenyl)-2-methylpropanamide

There total 4 articles about N-(3-cyanophenyl)-2-methylpropanamide 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:

benzonitrile (100-47-0) → 3-isobutyrylamino-benzonitrile (900710-59-0)

Guidance literature:

Multi-step reaction with 3 steps

1: concentrated sulfuric acid; KNO₃

2: tin dichloride; concentrated hydrochloric acid

With hydrogenchloride; sulfuric acid; potassium nitrate; tin(ll) chloride;

Reference yield:

3-nitro-aniline (99-09-2) → 3-isobutyrylamino-benzonitrile (900710-59-0)

Guidance literature:

Multi-step reaction with 3 steps

1: Diazotization_.Behandlung der Diazoniumsalzloesung mit Kaliumkupfercyanuer

2: tin dichloride; concentrated hydrochloric acid

With hydrogenchloride; tin(ll) chloride;

Reference yield:

3-nitrobenzonitrile (619-24-9) → 3-isobutyrylamino-benzonitrile (900710-59-0)

Guidance literature:

Multi-step reaction with 2 steps

1: tin dichloride; concentrated hydrochloric acid

With hydrogenchloride; tin(ll) chloride;

upstream raw materials:

2-Methylpropionic anhydride

m-cyanoaniline

benzonitrile

3-nitro-aniline

Downstream raw materials:

N-(3-(Aminomethyl)phenyl)isobutyramide