5-Nitrofuran-2-carbaldehyde phenylhydrazone

Base Information

• Chemical Name: 5-Nitrofuran-2-carbaldehyde phenylhydrazone
• CAS No.: 726-50-1
• Molecular Formula: C11H9N3O3
• Molecular Weight: 231.2075
• NSC Number: 53250
• DSSTox Substance ID: DTXSID00420784
• Nikkaji Number: J1.212.476G,J515.616E
• Mol file: 726-50-1.mol

Synonyms:NSC53250;5-Nitrofuran-2-carbaldehyde phenylhydrazone;726-50-1;DTXSID00420784;NSC-53250;5-Nitrofuran-2-carbaldehyde (E)-phenyl hydrazone;146827-84-1

Chemical Property of 5-Nitrofuran-2-carbaldehyde phenylhydrazone

Chemical Property:

• Vapor Pressure: 4.84E-06mmHg at 25°C
• Boiling Point: 382.1°Cat760mmHg
• Flash Point: 184.9°C
• Density: 1.32g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 231.06439116
• Heavy Atom Count: 17
• Complexity: 284

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NN=CC2=CC=C(O2)[N+](=O)[O-]
• Isomeric SMILES: C1=CC=C(C=C1)N/N=C\C2=CC=C(O2)[N+](=O)[O-]

Technology Process of 5-Nitrofuran-2-carbaldehyde phenylhydrazone

There total 1 articles about 5-Nitrofuran-2-carbaldehyde phenylhydrazone 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: 98.0%

5-nitrofurane-2-carboxaldehyde (698-63-5) + phenylhydrazine (100-63-0) → 1-(5-nitrofuran-2-ylmethylene)-2-phenylhydrazine (726-50-1)

Guidance literature:

phenylhydrazine; With acetic acid; In water; for 0.0833333h; Sonication;

5-nitrofurane-2-carboxaldehyde; In dimethyl sulfoxide; at 20 ℃; for 0.5h; Sonication;

DOI:10.1016/j.taap.2020.115104

Reference yield: 95.0%

2,3,5,6,7,8-hexahydro-6,8-dimethylpyrimido<5,4-e>(1,2,4)-triazine-3,5,7-trione (18969-83-0) + 1-(5-nitrofuran-2-ylmethylene)-2-phenylhydrazine (726-50-1) → 2,3,4,4a,5,6,7,8-Octahydro-4a-<(5-nitrofurylmethylidene)-p-hydrazinophenyl>-6,8-dimethylpyrimido<5,4-e><1,2,4>triazine-3,5,7-trione (113458-65-4)

Guidance literature:

In ethanol; for 1h; Heating;

DOI:10.1007/BF00758763

Reference yield: 94.0%

1-(5-nitrofuran-2-ylmethylene)-2-phenylhydrazine (726-50-1) → 5-nitro-2-furaldehyde 2-chloroformyl-2-phenylhydrazone (104707-46-2)

Guidance literature:

With phosgene; In pyridine; benzene; for 1.5h; Heating;

upstream raw materials:

5-nitrofurane-2-carboxaldehyde

phenylhydrazine

Downstream raw materials:

3-(5-nitro-furan-2-yl)-1,5-diphenyl-1H-pyrazole

5-methyl-3-(5-nitro-furan-2-yl)-1-phenyl-1H-pyrazole

5-(5-nitro-furan-2-yl)-2-phenyl-2H-pyrazole-3-carbonitrile

6-(5-nitro-furan-2-yl)-4-(4-nitro-phenyl)-2-phenyl-2,3,4,5-tetrahydro-[1,2,4]triazine

Refernces

• 1、 Newman,Strauss,Renfrow. "Correlation of antitumor activity and electron deficiency of nitrofuranylhydrazone compounds". . p. 831 - 834. Retrieved 2007/10/02.