1H-Imidazole, 4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-

Base Information

• Chemical Name: 1H-Imidazole, 4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-
• CAS No.: 75745-83-4
• Molecular Formula: C₁₃H₁₁N₃O₅S
• Molecular Weight: 321.313
• DSSTox Substance ID: DTXSID00226642
• Wikidata: Q83106125
• Mol file: 75745-83-4.mol

Synonyms:75745-83-4;BRN 4550773;1H-Imidazole, 4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-;4,5-Dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-1H-imidazole;DTXSID00226642;LS-78477;1H-Imidazole,4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-

Chemical Property of 1H-Imidazole, 4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-

Chemical Property:

• Vapor Pressure: 1.12E-12mmHg at 25°C
• Boiling Point: 562.4°C at 760 mmHg
• Flash Point: 294°C
• PSA: 125.87000
• Density: 1.62g/cm³
• LogP: 2.73880
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 321.04194163
• Heavy Atom Count: 22
• Complexity: 557

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN=C(N1)C2=CC=C(O2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Technology Process of 1H-Imidazole, 4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)-

There total 3 articles about 1H-Imidazole, 4,5-dihydro-2-((5-(4-nitrophenyl)sulfonyl)-2-furanyl)- 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: 63.0%

5-<(4-nitrophenyl)sulphonyl>-2-furancarboximidate HCl + ethylenediamine (107-15-3,85404-18-8) → 2-<(5-(4-nitrophenyl)sulphonyl)-2-furanyl>-imidazoline (75745-83-4)

Guidance literature:

In methanol; for 8h; Heating;

Reference yield:

5-<(4-nitrophenyl)sulphonyl>-2-furancarbonitrile (75745-64-1) → 2-<(5-(4-nitrophenyl)sulphonyl)-2-furanyl>-imidazoline (75745-83-4)

Guidance literature:

Multi-step reaction with 2 steps

1: HCl(g) / 48 h / 0 - 5 °C

2: 63 percent / methanol / 8 h / Heating

With hydrogenchloride; In methanol;

Reference yield:

5-<(4-nitrophenyl)thio>-2-furancarbonitrile (75745-89-0) → 2-<(5-(4-nitrophenyl)sulphonyl)-2-furanyl>-imidazoline (75745-83-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 54 percent / 46percent H₂O₂ / acetic acid / 75 h / Ambient temperature

2: HCl(g) / 48 h / 0 - 5 °C

3: 63 percent / methanol / 8 h / Heating

With hydrogenchloride; dihydrogen peroxide; In methanol; acetic acid;

upstream raw materials:

ethylenediamine

5-<(4-nitrophenyl)sulphonyl>-2-furancarbonitrile

5-<(4-nitrophenyl)thio>-2-furancarbonitrile