Methyl 2-(phenylcarbamoylamino)benzoate

Base Information

• Chemical Name: Methyl 2-(phenylcarbamoylamino)benzoate
• CAS No.: 2321-50-8
• Molecular Formula: C15H14 N2 O3
• Molecular Weight: 270.2833
• NSC Number: 164413
• DSSTox Substance ID: DTXSID10304167
• Wikidata: Q82049903
• Mol file: 2321-50-8.mol

Synonyms:2321-50-8;methyl 2-(phenylcarbamoylamino)benzoate;NSC164413;Oprea1_857867;SCHEMBL16127717;DTXSID10304167;STL012289;AKOS003000852;NSC-164413;methyl 2-[(anilinocarbonyl)amino]benzoate;methyl 2-[(phenylcarbamoyl)amino]benzoate

Chemical Property of Methyl 2-(phenylcarbamoylamino)benzoate

Chemical Property:

• Vapor Pressure: 0.000108mmHg at 25°C
• Boiling Point: 337°Cat760mmHg
• Flash Point: 157.6°C
• Density: 1.3g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 270.10044231
• Heavy Atom Count: 20
• Complexity: 340

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=CC=C1NC(=O)NC2=CC=CC=C2

Technology Process of Methyl 2-(phenylcarbamoylamino)benzoate

There total 4 articles about Methyl 2-(phenylcarbamoylamino)benzoate 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:

phenyl isocyanate (103-71-9) + 2-carbomethoxyaniline (134-20-3) → methyl 2-(3-phenylureido)benzoate (2321-50-8)

Guidance literature:

In diethyl ether;

Reference yield:

aniline (62-53-3) → methyl 2-(3-phenylureido)benzoate (2321-50-8)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / 1,2-dichloro-ethane / Heating

2: 1,2-dichloro-ethane / Heating

With triethylamine; In 1,2-dichloro-ethane;

DOI:10.1248/cpb.51.1273

Reference yield:

N-carboethoxyaniline (101-99-5) + 2-carbomethoxyaniline (134-20-3) → methyl 2-(3-phenylureido)benzoate (2321-50-8)

Guidance literature:

With potassium carbonate; for 0.333333h; microwave irradiation;

upstream raw materials:

phenyl isocyanate

2-carbomethoxyaniline

N-carboethoxyaniline

aniline

Downstream raw materials:

2-(phenylamino)-4H-benzo[d][1,3]oxazin-4-one

3-phenyl-2,4-(1H,3H)-quinazolinedione