2-Furancarbonitrile, 5-phenyl-

Base Information

• Chemical Name: 2-Furancarbonitrile, 5-phenyl-
• CAS No.: 57666-50-9
• Molecular Formula: C11H7NO
• Molecular Weight: 169.183
• DSSTox Substance ID: DTXSID00481350
• Nikkaji Number: J1.556.399K
• Wikidata: Q82316704

Synonyms:5-phenyl-2-furonitrile;2-Furancarbonitrile, 5-phenyl-;57666-50-9;SCHEMBL11733368;DTXSID00481350;LEPUGNMSTZGEAG-UHFFFAOYSA-N

Chemical Property of 2-Furancarbonitrile, 5-phenyl-

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 169.052763847
• Heavy Atom Count: 13
• Complexity: 211

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(O2)C#N

Technology Process of 2-Furancarbonitrile, 5-phenyl-

There total 5 articles about 2-Furancarbonitrile, 5-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: 92.0%

5-phenylfuran-2-carboxaldehyde oxime (13803-16-2) → 5-phenylfuran-2-carbonitrile (57666-50-9)

Guidance literature:

With pyridine; thionyl chloride; urethane; In toluene; for 2h; Heating;

DOI:10.1039/b101157j

Reference yield: 90.0%

5-phenylfuran-2-carbaldehyde (13803-39-9) → 5-phenylfuran-2-carbonitrile (57666-50-9)

Guidance literature:

With magnesium(II) perchlorate; tris-(2-chloro-ethyl)-amine; In chloroform; for 2h; Heating;

DOI:10.1023/A:1019544726068

Reference yield: 80.0%

methanol (67-56-1) + 5-phenylfuran-2-carbaldehyde (13803-39-9) → 5-phenyl-furan-2-carboximidic acid methyl ester + 5-phenylfuran-2-carbonitrile (57666-50-9)

Guidance literature:

With ammonia; oxygen; In water; at 30 ℃; for 48h; under 3750.38 Torr; Autoclave;

DOI:10.1039/c6cy00874g

upstream raw materials:

5-phenylfuran-2-carbaldehyde

5-phenyl-furan-2-carbaldehyde oxime

5-phenylfuran-2-carboxaldehyde oxime

2-phenylfuran

Downstream raw materials:

5-(5-phenyl-furan-2-yl)-1⁽²⁾H-tetrazole

N²-Phenyl-5-phenylfuran-2-carboximidamide

N¹-Acetyl-N¹-(5-phenyl-2-furyl)-N²-phenylurea

2-(5-phenyl-furan-2-yl)imidazole hydrochloride

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