n-Tert-butyl-2-chloro-2-phenylacetamide

Base Information

• Chemical Name: n-Tert-butyl-2-chloro-2-phenylacetamide
• CAS No.: 65117-34-2
• Molecular Formula: C12H16 Cl N O
• Molecular Weight: 225.718
• NSC Number: 126781
• DSSTox Substance ID: DTXSID80298887
• Nikkaji Number: J1.238.152B
• Mol file: 65117-34-2.mol

Synonyms:65117-34-2;n-tert-butyl-2-chloro-2-phenylacetamide;NSC126781;DTXSID80298887;AKOS008967698;NSC-126781

Chemical Property of n-Tert-butyl-2-chloro-2-phenylacetamide

Chemical Property:

• Vapor Pressure: 1.63E-05mmHg at 25°C
• Boiling Point: 364.9°Cat760mmHg
• Flash Point: 174.5°C
• Density: 1.093g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 225.0920418
• Heavy Atom Count: 15
• Complexity: 216

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)NC(=O)C(C1=CC=CC=C1)Cl

Technology Process of n-Tert-butyl-2-chloro-2-phenylacetamide

There total 6 articles about n-Tert-butyl-2-chloro-2-phenylacetamide 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: 90.0%

α-chlorophenylacetyl chloride (2912-62-1) + tert-butylamine (75-64-9) → N-tert-butyl-2-chloro-2-phenylethanamide (65117-34-2)

Guidance literature:

In diethyl ether; at 0 ℃;

Reference yield: 79.0%

N-phenylacetyl-N-tert-butylhydroxylamine (68872-03-7) → N-tert-butyl-2-chloro-2-phenylethanamide (65117-34-2)

Guidance literature:

With triethylamine hydrochloride; methanesulfonyl chloride; triethylamine; In dichloromethane; 1) 0 deg C, 30 min, 2) r.t.;

DOI:10.1021/jo00047a024

Reference yield: 79.0%

N-(mesyloxy)-N-tert-butylphenylacetamide (143217-11-2) → N-tert-butyl-2-chloro-2-phenylethanamide (65117-34-2)

Guidance literature:

With triethylamine hydrochloride; triethylamine;

DOI:10.1021/ja00041a064

upstream raw materials:

N-phenylacetyl-N-tert-butylhydroxylamine

N-(mesyloxy)-N-tert-butylphenylacetamide

α-chlorophenylacetyl chloride

tert-butylamine

Downstream raw materials:

N-tert-butyl-2-phenyl-2-<(N-isopropylthiocarbamoyl)thio>acetamide

N-(tert-Butyl)-2-<3-(tert-butyl)-1-methylureido>-2-phenylacetamid

2-(Methylamino)-N-(tert-butyl)-2-phenyl-acetamid-hydrochlorid