2-Benzofurancarboximidamide, N-phenyl-

Base Information

• Chemical Name: 2-Benzofurancarboximidamide, N-phenyl-
• CAS No.: 72583-88-1
• Molecular Formula: C15H12 N2 O
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID20222904
• Nikkaji Number: J1.521.340J
• Mol file: 72583-88-1.mol

Synonyms:2-Benzofurancarboximidamide, N-phenyl-;72583-88-1;N-Phenyl-2-benzofurancarboximidamide;N'-Phenyl-1-benzo[b]furan-2-carboximidamide;DTXSID20222904;N'-Phenylbenzofuran-2-carboxamidine;LS-34968

Chemical Property of 2-Benzofurancarboximidamide, N-phenyl-

Chemical Property:

• Boiling Point: 405.8oC at 760 mmHg
• Flash Point: 199.2oC
• PSA: 49.02000
• Density: 1.2g/cm3
• LogP: 4.04300
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 236.094963011
• Heavy Atom Count: 18
• Complexity: 310

Purity/Quality:

N-PHENYL-2-BENZOFURANCARBOXIMIDAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N=C(C2=CC3=CC=CC=C3O2)N

Technology Process of 2-Benzofurancarboximidamide, N-phenyl-

There total 2 articles about 2-Benzofurancarboximidamide, N-phenyl- 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: 93.0%

benzofuran-2-carbonitrile (41717-32-2) + aniline (62-53-3) → N2-Phenylbenzo[b]furan-2-carboximidamide (72583-88-1)

Guidance literature:

With aluminium trichloride; In dichloromethane;

DOI:10.1039/b010010m

Reference yield:

2-formylbenzo[b]furan (4265-16-1) → N2-Phenylbenzo[b]furan-2-carboximidamide (72583-88-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 80 percent / H₂NOH*HCl; pyridine; Ac₂O / 2 h / 85 - 95 °C

2: 93 percent / AlCl₃ / CH₂Cl₂

With pyridine; aluminium trichloride; hydroxylamine hydrochloride; acetic anhydride; In dichloromethane;

DOI:10.1039/b010010m

Reference yield: 14.0%

N2-Phenylbenzo[b]furan-2-carboximidamide (72583-88-1) → N1-Acetyl-N1-(benzo[b]furan-2-yl)-N2-phenylurea (350692-34-1) + N1-(N-Phenylcarbamoyl)-N2-(phenyl)benzo[b]furan-2-carboximidamide + 2-Phenylamino-4-(benzo[b]furan-2-yl)benzo[4,5]furo[2,3-d]pyrimidine

Guidance literature:

With [bis(acetoxy)iodo]benzene; In toluene; at 60 ℃;

DOI:10.1039/b010010m

upstream raw materials:

benzofuran-2-carbonitrile

aniline

2-formylbenzo[b]furan

Downstream raw materials:

N¹-Acetyl-N¹-(benzo[b]furan-2-yl)-N²-phenylurea

N-(benzofuran-2-yl)acetamide