1-Methyl-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione

Base Information

• Chemical Name: 1-Methyl-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
• CAS No.: 58802-03-2
• Molecular Formula: C₁₉H₁₄O₃
• Molecular Weight: 290.318
• NSC Number: 110663

Synonyms:NSC110663;58802-03-2;NSC 110663;NSC-110663

Chemical Property of 1-Methyl-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione

Chemical Property:

• Vapor Pressure: 1.79E-09mmHg at 25°C
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 290.094294304
• Heavy Atom Count: 22
• Complexity: 515

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)OC3=O

Technology Process of 1-Methyl-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione

There total 2 articles about 1-Methyl-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-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: 95.0%

maleic anhydride (108-31-6) + 9-methylanthracene (779-02-2) → 9,10-dihydroanthracene-9,10-α,β-succinimidederivative (58802-03-2)

Guidance literature:

In 1,4-dioxane; for 19h; Thermodynamic data; Kinetics; Rate constant; Heating;

Reference yield: 90.0%

maleic anhydride (108-31-6) + 9-methylanthracene (779-02-2) → 9-methyl-9,10-dihydro-9,10-[3,4]furanoanthracene-12,14-dione (58802-03-2)

Guidance literature:

In 5,5-dimethyl-1,3-cyclohexadiene; for 0.5h; Reflux;

DOI:10.1002/cctc.201501295

Reference yield: 96.0%

9,10-dihydroanthracene-9,10-α,β-succinimidederivative (58802-03-2) + benzylamine (100-46-9) → 3a,4,9,9a-tetrahydro-2-(phenylmethyl)-4,9-[1',2']-benzeno-1H-benz[f]isoindole-1,3-(2H)-dione

Guidance literature:

for 0.166667h; Milling;

DOI:10.1007/s00044-012-0439-6

upstream raw materials:

maleic anhydride

9-methylanthracene

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