N-benzhydryl-2-phenylcyclopropane-1-carboxamide

Base Information

• Chemical Name: N-benzhydryl-2-phenylcyclopropane-1-carboxamide
• CAS No.: 5230-70-6
• Molecular Formula: C23H21NO
• Molecular Weight: 327.4189
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID40385449
• Mol file: 5230-70-6.mol

Synonyms:N-benzhydryl-2-phenylcyclopropane-1-carboxamide;5230-70-6;N-(Diphenylmethyl)-2-phenylcyclopropane-1-carboxamide;CBMicro_009160;Cambridge id 5230706;Oprea1_662943;DTXSID40385449;SMSF0004996;STK182844;AKOS003658688;CB12240;NCGC00340552-01;BIM-0009230.P001;N-benzhydryl-2-phenylcyclopropanecarboxamide;AB01223242-03;AO-365/43233056;N-(diphenylmethyl)-2-phenylcyclopropanecarboxamide

Chemical Property of N-benzhydryl-2-phenylcyclopropane-1-carboxamide

Chemical Property:

• Vapor Pressure: 2.28E-12mmHg at 25°C
• Boiling Point: 555.3°Cat760mmHg
• Flash Point: 336.2°C
• PSA: 32.59000
• Density: 1.16g/cm³
• LogP: 5.53620
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 327.162314293
• Heavy Atom Count: 25
• Complexity: 411

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C1C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Technology Process of N-benzhydryl-2-phenylcyclopropane-1-carboxamide

There total 5 articles about N-benzhydryl-2-phenylcyclopropane-1-carboxamide 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: 92.0%

2-(Aminomethyl)pyridine (3731-51-9) + [1,4]naphthoquinone (130-15-4) → 2-((pyridine-2-yl)methylamino)naphthalene-1,4-dione (5230-70-6)

Guidance literature:

In methanol; at 20 ℃; for 8h;

DOI:10.1016/j.poly.2012.12.018

Reference yield: 62.14%

2-(Aminomethyl)pyridine (3731-51-9) + 2-methoxy-1,4-naphthoquinone (2348-82-5) → 2-((pyridine-2-yl)methylamino)naphthalene-1,4-dione (5230-70-6)

Guidance literature:

In methanol; dichloromethane; at 26 - 60 ℃; for 72h;

DOI:10.1039/c7ra10490a

Reference yield: 29.0%

2-(Aminomethyl)pyridine (3731-51-9) + 2-bromo-1,4-naphthoquinone (2065-37-4) → 2-((pyridine-2-yl)methylamino)naphthalene-1,4-dione (5230-70-6)

Guidance literature:

In ethanol; at 20 ℃; for 0.166667h; Green chemistry;

DOI:10.1021/jm301485d

upstream raw materials:

2-(Aminomethyl)pyridine

2-bromo-1,4-naphthoquinone

[1,4]naphthoquinone

2-hydroxynaphtho-1,4-quinone

Refernces

• 1、 Jali, Bigyan Ranjan,Masud, Kazi,Baruah, Jubaraj B.. "Selectivity in changes of fluorescence emission of 1,4-naphthoquinone derivatives by manganese and cadmium ions". . p. 75 - 81. Retrieved 2013.
• 2、 Carneiro, José Walkimar M.,Costa, Pedro Mikael S.,Filho, Eclair Venturini,Fiorot, Rodolfo G.,Gomes, Anne Caroline C.,Greco, Sandro J.,Guimar?es, Celina J.,Lemos, Bárbara C.,Pessoa, Claudia,Westphal, Regina,de Oliveira, Fátima C. E.. "Synthetic enamine naphthoquinone derived from lawsone as cytotoxic agents assessed by in vitro and in silico evaluations". . . Retrieved 2021/11/11.