Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-

Base Information

• Chemical Name: Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-
• CAS No.: 100253-83-6
• Molecular Formula: C12H16N2O2
• Molecular Weight: 220.271
• DSSTox Substance ID: DTXSID40443093
• Nikkaji Number: J1.278.335C
• Wikidata: Q82260799
• Mol file: 100253-83-6.mol

Synonyms:n-benzyl-n-nitrosopivalamide;100253-83-6;Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-;SCHEMBL7195637;DTXSID40443093;N-benzyl-2,2-dimethyl-N-nitrosopropanamide

Chemical Property of Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 220.121177757
• Heavy Atom Count: 16
• Complexity: 252

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C(=O)N(CC1=CC=CC=C1)N=O

Technology Process of Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)-

There total 2 articles about Propanamide, 2,2-dimethyl-N-nitroso-N-(phenylmethyl)- 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: 100.0%

N-benzyl-2,2-dimethylpropanamide (26209-45-0) → N-benzyl-N-nitrosopivalamide (100253-83-6)

Guidance literature:

With sodium acetate; dinitrogen tetraoxide; sodium sulfate; In dichloromethane; at -78 - -25 ℃; for 0.583333h;

DOI:10.1021/jo001458m

Reference yield:

→ N-benzyl-N-nitrosopivalamide (100253-83-6)

Guidance literature:

/BRN= 2640940/;

Reference yield:

2-Chlorobenzonitrile (873-32-5) + N-benzyl-N-nitrosopivalamide (100253-83-6) → benzyl pivalate (2094-69-1) + N-(o-chlorobenzoyl)benzylamine (7506-50-5) + benzyl alcohol (100-51-6,185532-71-2) + N-benzyl-2-chloro-N-(2,2-dimethyl-propionyl)-benzamide

Guidance literature:

at 60 ℃; for 1h; Title compound not separated from byproducts.;

DOI:10.1039/b204255j

upstream raw materials:

N-benzyl-2,2-dimethylpropanamide

Downstream raw materials:

benzyl pivalate

benzyl alcohol

N-benzyl-2-methylbenzamide

N-benzylbenzamide

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