1-Nitroso-4-propylbenzene

Base Information

• Chemical Name: 1-Nitroso-4-propylbenzene
• CAS No.: 67083-39-0
• Molecular Formula: C9H11NO
• Molecular Weight: 149.192
• DSSTox Substance ID: DTXSID50545678
• Mol file: 67083-39-0.mol

Synonyms:1-Nitroso-4-propylbenzene;67083-39-0;nitrosyl-4-propylbenzene;SCHEMBL2289401;DTXSID50545678;XHNUYMNRCLHBFU-UHFFFAOYSA-N

Chemical Property of 1-Nitroso-4-propylbenzene

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 149.084063974
• Heavy Atom Count: 11
• Complexity: 117

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=CC=C(C=C1)N=O

Technology Process of 1-Nitroso-4-propylbenzene

There total 4 articles about 1-Nitroso-4-propylbenzene 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: 94.4%

p-propylphenylhydroxylamine → 1-propyl-4-nitrosobenzene (67083-39-0)

Guidance literature:

With iron(III) chloride; In ethanol; water; at 10 ℃;

Reference yield:

4-propylaniline (2696-84-6) → 1-propyl-4-nitrosobenzene (67083-39-0)

Guidance literature:

With Oxone; In dichloromethane; water; for 1h; Inert atmosphere;

DOI:10.1002/anie.200904504

Reference yield:

1-nitro-4-propyl-benzene (10342-59-3) → 1-propyl-4-nitrosobenzene (67083-39-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 70.3 percent / NH₄Cl, Zn / ethanol; H₂O / 0.5 h / 40 - 45 °C

2: 94.4 percent / FeCl₃ / ethanol; H₂O / 10 °C

With iron(III) chloride; ammonium chloride; zinc; In ethanol; water;

upstream raw materials:

1-nitro-4-propyl-benzene

4-propylaniline

Downstream raw materials:

4-amino-4'-propylazobenzene

4-propyl-azobenzene

4,4'-Di-n-propylazoxybenzol

N-(4-Octyl-phenyl)-N'-(4-propyl-phenyl)-diazene N'-oxide

Refernces

• 1、 Lux, Jacques,Rebek, Julius. "Reversible switching between self-assembled homomeric and hybrid capsules". supporting information. p. 2127 - 2129. Retrieved 2013/03/28.
• 2、 Dabrowski, Roman,Kenig, Krystyna. "Mesomorphic Properties of the Homologous Series of 4-n-Propyl-4'-n-alkylazobenzenes and 4-n-Propyl-4'-n-alkylazoxybenzenes". . p. 183 - 189. Retrieved 2007/10/02.