9-Methyl-1H-isochromeno[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetraone

Base Information

• Chemical Name: 9-Methyl-1H-isochromeno[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetraone
• CAS No.: 70654-96-5
• Molecular Formula: C₂₅H₁₁NO₅
• Molecular Weight: 405.366
• European Community (EC) Number: 615-137-7
• NSC Number: 334706
• DSSTox Substance ID: DTXSID30318741
• Nikkaji Number: J771.998A
• Wikidata: Q82074714
• Mol file: 70654-96-5.mol

Synonyms:70654-96-5;9-Methyl-1H-isochromeno[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetraone;NSC334706;SCHEMBL12672639;DTXSID30318741;NSC 334706;NSC-334706;9-Methyl-1H-[2]benzopyrano[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetrone;9-Methyl-9H-2-benzopyrano[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10-tetrone

Chemical Property of 9-Methyl-1H-isochromeno[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetraone

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 405.06372245
• Heavy Atom Count: 31
• Complexity: 832

Purity/Quality:

98.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C7C6=C(C=C5)C(=O)OC7=O)C1=O

Technology Process of 9-Methyl-1H-isochromeno[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetraone

There total 1 articles about 9-Methyl-1H-isochromeno[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(9H)-tetraone 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:

N,N'-Dimethylperylene-3,4,9,10-biscarboximide (5521-31-3) → N-methyl-3,4:9,10-perylenetetracarboxylic monoanhydride monoimide (70654-96-5) + perylene-3,4,9,10-tetracarboxylic acid 3,4:9,10-dianhydride (128-69-8)

Guidance literature:

With sulfuric acid; at 180 ℃; for 4.5h; Rate constant; Product distribution; Mechanism; other N,N'-dialkyl-3,4:9,10-perylenebis(dicarboximides), var. temperatures;

DOI:10.1246/bcsj.54.1269

upstream raw materials:

N,N'-Dimethylperylene-3,4,9,10-biscarboximide