1-(3-Iodopropyl)-4-nitrobenzene

Base Information

• Chemical Name: 1-(3-Iodopropyl)-4-nitrobenzene
• CAS No.: 100708-34-7
• Molecular Formula: C9H10INO2
• Molecular Weight: 291.088
• DSSTox Substance ID: DTXSID30692871
• Wikidata: Q82621909
• ChEMBL ID: CHEMBL1774701
• Mol file: 100708-34-7.mol

Synonyms:1-(3-iodopropyl)-4-nitrobenzene;100708-34-7;CHEMBL1774701;SCHEMBL18045583;DTXSID30692871

Chemical Property of 1-(3-Iodopropyl)-4-nitrobenzene

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 290.97563
• Heavy Atom Count: 13
• Complexity: 162

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CCCI)[N+](=O)[O-]

Technology Process of 1-(3-Iodopropyl)-4-nitrobenzene

There total 10 articles about 1-(3-Iodopropyl)-4-nitrobenzene 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%

1-bromo-3-(4-nitrophenyl)propane (53712-77-9) → 1-iodo-3-(4-nitrophenyl)propane (100708-34-7)

Guidance literature:

With sodium iodide; In acetone; for 17h; Heating;

DOI:10.1021/jo025508u

Reference yield: 97.0%

3-(4-nitrophenyl)-1-propanol (20716-25-0) → 1-iodo-3-(4-nitrophenyl)propane (100708-34-7)

Guidance literature:

With 1H-imidazole; iodine; triphenylphosphine; In toluene; at 20 ℃; for 3h; Inert atmosphere;

DOI:10.1021/jm101182s

Reference yield:

3-(4'-nitrophenyl)propyl methanesulfonate (99676-62-7) → 1-iodo-3-(4-nitrophenyl)propane (100708-34-7)

Guidance literature:

With sodium iodide; In acetone; at 20 ℃; for 18h;

DOI:10.1021/jm00173a015

upstream raw materials:

3-(4-nitrophenyl)propyl chloride

3-(4'-nitrophenyl)propyl methanesulfonate

1-bromo-3-(4-nitrophenyl)propane

1-Bromo-3-phenylpropane

Downstream raw materials:

2-[3-(4-Nitro-phenyl)-propyl]-propane-1,3-diol

ethyl 5-(4-aminophenyl)-2-phenylpentanoate

ethyl 5-(4-azidophenyl)-2-phenylpentanoate

ethyl 4-(4-aminophenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylate

Refernces

• 1、 Blankespoor, Ronald L.,DeVries, Tim,Hansen, Eric,Kallemeyn, Jeffrey M.,Klooster, Aaron M.,Mulder, Jason A.,Smart, Robert P.,Vander Griend, Douglas A.. "Photochemical synthesis of aldehydes in the solid phase". . p. 2677 - 2681. Retrieved 2007/10/03.