2-(2-Methyl-4-nitrophenyl)isoindole-1,3-dione

Base Information

• Chemical Name: 2-(2-Methyl-4-nitrophenyl)isoindole-1,3-dione
• CAS No.: 33329-27-0
• Molecular Formula: C₁₅H₁₀N₂O₄
• Molecular Weight: 282.255
• DSSTox Substance ID: DTXSID30385791
• Wikidata: Q82178785
• ChEMBL ID: CHEMBL24143
• Mol file: 33329-27-0.mol

Synonyms:33329-27-0;2-(2-Methyl-4-nitrophenyl)isoindoline-1,3-dione;N-(2-methyl-4-nitrophenyl)phthalimide;2-(2-methyl-4-nitrophenyl)isoindole-1,3-dione;CCG-7679;2-(2-methyl-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione;CBMicro_020738;Oprea1_815044;CHEMBL24143;SCHEMBL10885870;DTXSID30385791;UWPGHHBXUBDHAQ-UHFFFAOYSA-N;STK058146;AKOS000487610;BIM-0020582.P001;SR-01000207451;SR-01000207451-1;2-(2-methyl-4-nitrophenyl)-2,3-dihydro-1H-isoindole-1,3-dione

Chemical Property of 2-(2-Methyl-4-nitrophenyl)isoindole-1,3-dione

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 282.06405680
• Heavy Atom Count: 21
• Complexity: 449

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=CC=CC=C3C2=O

Technology Process of 2-(2-Methyl-4-nitrophenyl)isoindole-1,3-dione

There total 2 articles about 2-(2-Methyl-4-nitrophenyl)isoindole-1,3-dione 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: 91.0%

phthalic anhydride (85-44-9) + 2-methyl-4-nitro-benzenamine (99-52-5) → 2-(2-methyl-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione (33329-27-0)

Guidance literature:

With acetic acid; for 6h; Heating;

DOI:10.1016/j.ejmech.2005.10.008

Reference yield:

→ 2-(2-methyl-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione (33329-27-0)

Guidance literature:

1-Brom-2-methyl-4-nitrobrombenzol, Kalium-Phthalimid, CuI;

Reference yield: 77.8%

2-(2-methyl-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione (33329-27-0) → 2-(4-amino-2-methylphenyl)isoindoline-1,3-dione (33329-28-1)

Guidance literature:

With cyclohexene; 10percent Pd/C; In isopropyl alcohol; Heating;

DOI:10.1021/jm990068t

upstream raw materials:

phthalic anhydride

2-methyl-4-nitro-benzenamine

Downstream raw materials:

2-(4-amino-2-methylphenyl)isoindoline-1,3-dione