4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzaldehyde

Base Information

• Chemical Name: 4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzaldehyde
• CAS No.: 30529-14-7
• Molecular Formula: C₁₄H₁₁N₃O₃
• Molecular Weight: 269.26
• NSC Number: 271226
• DSSTox Substance ID: DTXSID70422235
• Wikidata: Q82234099
• Mol file: 30529-14-7.mol

Synonyms:NSC271226;30529-14-7;DTXSID70422235;NSC-271226;2-(4-formyl-styryl)-5-nitro-1-vinylimidazole

Chemical Property of 4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzaldehyde

Chemical Property:

• Vapor Pressure: 7.4E-12mmHg at 25°C
• Boiling Point: 543.1°Cat760mmHg
• Flash Point: 282.3°C
• Density: 1.23g/cm³
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 269.08004122
• Heavy Atom Count: 20
• Complexity: 397

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CN1C(=CN=C1C=CC2=CC=C(C=C2)C=O)[N+](=O)[O-]
• Isomeric SMILES: C=CN1C(=CN=C1/C=C/C2=CC=C(C=C2)C=O)[N+](=O)[O-]

Technology Process of 4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzaldehyde

There total 1 articles about 4-[(E)-2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzaldehyde 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:

→ 4-[2-(5-nitro-1-vinyl-1H-imidazol-2-yl)-vinyl]-benzaldehyde (30529-14-7)

Guidance literature:

Imidazol (4);

DOI:10.1021/jm00262a008

Reference yield:

ethane-1,2-dithiol (540-63-6) + 4-[2-(5-nitro-1-vinyl-1H-imidazol-2-yl)-vinyl]-benzaldehyde (30529-14-7) → 2-(4-[1,3]dithiolan-2-yl-styryl)-5-nitro-1-vinyl-1H-imidazole (54738-34-0)

Guidance literature:

With toluene-4-sulfonic acid; In benzene; Heating;

DOI:10.1021/jm00236a009

Reference yield:

2-hydroxyethanethiol (60-24-2) + 4-[2-(5-nitro-1-vinyl-1H-imidazol-2-yl)-vinyl]-benzaldehyde (30529-14-7) → 5-nitro-2-(4-[1,3]oxathiolan-2-yl-styryl)-1-vinyl-1H-imidazole (54738-33-9)

Guidance literature:

With toluene-4-sulfonic acid; In benzene; Heating;

DOI:10.1021/jm00236a009

Downstream raw materials:

morpholin-4-yl-{4-[2-(5-nitro-1-vinyl-1H-imidazol-2-yl)-vinyl]-benzylidene}-amine

2-(4-[1,3]dithiolan-2-yl-styryl)-5-nitro-1-vinyl-1H-imidazole

{4-[2-(5-nitro-1-vinyl-1H-imidazol-2-yl)-vinyl]-benzylidene}-thiomorpholin-4-yl-amine

5-nitro-2-(4-[1,3]oxathiolan-2-yl-styryl)-1-vinyl-1H-imidazole

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