N-Butyl-2,2-diphenylacetamide

Base Information

• Chemical Name: N-Butyl-2,2-diphenylacetamide
• CAS No.: 4107-02-2
• Molecular Formula: C₁₈H₂₁NO
• Molecular Weight: 267.371
• Hs Code.: 2924299090
• NSC Number: 401982
• UNII: HVH08Q95RW
• DSSTox Substance ID: DTXSID20194031
• Nikkaji Number: J54.057I
• Wikidata: Q83066761
• Mol file: 4107-02-2.mol

Synonyms:N-Butyl-2,2-diphenylacetamide;4107-02-2;Acetamide, N-butyl-2,2-diphenyl-;HVH08Q95RW;NSC-401982;NSC401982;NSC 401982;Benzeneacetamide, N-butyl-alpha-phenyl-;BRN 2122659;UNII-HVH08Q95RW;SCHEMBL6436285;N-Butyl-2,2-diphenyl-acetamide;DTXSID20194031;DWTFZCMKNAQOCN-UHFFFAOYSA-N;AKOS002960159;Benzeneacetamide, N-butyl-.alpha.-phenyl-;AG-690/03073054

Chemical Property of N-Butyl-2,2-diphenylacetamide

Chemical Property:

• Vapor Pressure: 1.73E-08mmHg at 25°C
• Boiling Point: 455.6°Cat760mmHg
• Flash Point: 277.8°C
• PSA: 29.10000
• Density: 1.036g/cm³
• LogP: 4.12570
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 267.162314293
• Heavy Atom Count: 20
• Complexity: 259

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCNC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2

Technology Process of N-Butyl-2,2-diphenylacetamide

There total 2 articles about N-Butyl-2,2-diphenylacetamide 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: 45.0%

(C6H5)2CHCOCCl3 (78437-39-5) + N-butylamine (109-73-9,85404-21-3) → N-butyl-2,2-diphenyl acetamide (4107-02-2) + 3,3-diphenyl-1-n-butylamin-1-yl-propen-1-one (96014-15-2)

Guidance literature:

In acetonitrile; at 20 ℃; for 4h;

DOI:10.1016/S0040-4020(00)00360-4

Reference yield:

→ N-butyl-2,2-diphenyl acetamide (4107-02-2)

Guidance literature:

/BRN= 1968232/;

DOI:10.1021/ja01646a038

Reference yield: 80.0%

oxalyl dichloride (79-37-8) + N-butyl-2,2-diphenyl acetamide (4107-02-2) → 3-butyl-2-diphenylmethyleneoxazoline-4,5-dione

Guidance literature:

In benzene; at 60 ℃; for 12h;

DOI:10.1016/S0957-4166(98)00499-6

upstream raw materials:

(C₆H₅)2CHCOCCl₃

N-butylamine

Downstream raw materials:

N-(n-Butyl)diphenylketene imine