2,4-Dimethyl-1-nitrosobenzene

Base Information

• Chemical Name: 2,4-Dimethyl-1-nitrosobenzene
• CAS No.: 38974-06-0
• Molecular Formula: C8H9NO
• Molecular Weight: 135.166
• DSSTox Substance ID: DTXSID70497620
• Nikkaji Number: J618.544D
• Wikidata: Q82347291
• Mol file: 38974-06-0.mol

Synonyms:2,4-Dimethyl-1-nitrosobenzene;38974-06-0;4-Nitroso-1,3-xylol;SCHEMBL12589735;DTXSID70497620

Chemical Property of 2,4-Dimethyl-1-nitrosobenzene

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 135.068413911
• Heavy Atom Count: 10
• Complexity: 124

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)N=O)C

Technology Process of 2,4-Dimethyl-1-nitrosobenzene

There total 10 articles about 2,4-Dimethyl-1-nitrosobenzene 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: 96.0%

m-xylene (108-38-3,104809-90-7) → 1,3-dimethyl-4-nitrosobenzene (38974-06-0)

Guidance literature:

With nitric oxide; trifluoroacetic acid; trifluoroacetic anhydride; at 28 ℃; for 5h; Product distribution;

DOI:10.1039/a700935f

Reference yield: 90.0%

2,4-Xylidine (95-68-1) → 1,3-dimethyl-4-nitrosobenzene (38974-06-0)

Guidance literature:

With dihydrogen peroxide; (n-Bu₃Sn)2WO₄; In acetone; at 20 ℃; for 1h;

DOI:10.1002/adsc.200700224

Reference yield:

C8H10*NO(1+) → 2,4-dimethylnitrobenzene (89-87-2,156617-89-9,37551-97-6) + 1,3-dimethyl-4-nitrosobenzene (38974-06-0)

Guidance literature:

With nitric oxide; In trifluoroacetic acid; at 28 ℃; Rate constant;

upstream raw materials:

N-(2,4-dimethylphenyl)hydroxylamine

m-xylene

2,4-Xylidine

1-methyl-4-nitrobenzene

Downstream raw materials:

bis-(2,4-dimethyl-phenyl)-diazene-N-oxide

dimethyl 5-((2,4-dimethylphenyl)diazenyl)isophthalate

5-((2,4-dimethylphenyl)diazenyl)isophthalic acid