Benzamide, N-((4-chlorobenzoyl)oxy)-N-(phenylmethoxy)-

Base Information

• Chemical Name: Benzamide, N-((4-chlorobenzoyl)oxy)-N-(phenylmethoxy)-
• CAS No.: 220168-45-6
• Molecular Formula: C21H16 Cl N O4
• Molecular Weight: 381.815
• DSSTox Substance ID: DTXSID10176467
• Nikkaji Number: J1.075.791F
• Wikidata: Q83046795
• Mol file: 220168-45-6.mol

Synonyms:CCRIS 8782;220168-45-6;Benzamide, N-((4-chlorobenzoyl)oxy)-N-(phenylmethoxy)-;N-((4-Chlorobenzoyl)oxy)-N-(phenylmethoxy)benzamide;N-[(4-CHLOROBENZOYL]OXY]-N-(PHENYLMETHOXY)BENZAMIDE;DTXSID10176467;LS-26028;N-(4-Chlorobenzoyloxy)-N-(benzyloxy)benzamide

Chemical Property of Benzamide, N-((4-chlorobenzoyl)oxy)-N-(phenylmethoxy)-

Chemical Property:

• Vapor Pressure: 1.87E-10mmHg at 25°C
• Boiling Point: 508.4°Cat760mmHg
• Flash Point: 261.3°C
• Density: 1.318g/cm³
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 381.0767857
• Heavy Atom Count: 27
• Complexity: 481

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CON(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Cl

Technology Process of Benzamide, N-((4-chlorobenzoyl)oxy)-N-(phenylmethoxy)-

There total 2 articles about Benzamide, N-((4-chlorobenzoyl)oxy)-N-(phenylmethoxy)- 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:

N-benzyloxy benzamide (3532-25-0) → N-(benzyloxy)-N-((4-chlorobenzoyl)oxy)benzamide (220168-45-6)

Guidance literature:

Multi-step reaction with 2 steps

1: tert-butyl hypochlorite / CH₂Cl₂ / 5 h

2: 83 percent Chromat_. / acetone / Ambient temperature

With tert-butylhypochlorite; In dichloromethane; acetone;

DOI:10.1021/jo980863z

Reference yield:

sodium p-chlorobenzoate (3686-66-6) + benzyl N-chlorobenzohydroxamate (112403-68-6) → N-(benzyloxy)-N-((4-chlorobenzoyl)oxy)benzamide (220168-45-6)

Guidance literature:

In acetone; Ambient temperature;

DOI:10.1021/jo980863z

Reference yield:

N-(benzyloxy)-N-((4-chlorobenzoyl)oxy)benzamide (220168-45-6) → N-benzoyl-N-(benzyloxy)nitrenium ion + para-chlorobenzoic acid (74-11-3)

Guidance literature:

With sulfuric acid; In [D₃]acetonitrile; water-d2; at 34.85 ℃; Rate constant; Thermodynamic data; bimolecular rate constant and Arrhenius data (ln A, ΔS<*>, E_a); acid-independent rate constants at 298-338 K;

DOI:10.1021/jo980863z

upstream raw materials:

sodium p-chlorobenzoate

benzyl N-chlorobenzohydroxamate

N-benzyloxy benzamide

Downstream raw materials:

para-chlorobenzoic acid

benzoic acid benzyl ester

1,4-dimethyl-1,4-diphenyl-2-tetrazine

N-benzyloxy benzamide