2,3-Dihydro-1H-benzo[f]isoindole

Base Information

• Chemical Name: 2,3-Dihydro-1H-benzo[f]isoindole
• CAS No.: 6247-15-0
• Molecular Formula: C₁₂H₁₁N
• Molecular Weight: 169.226
• DSSTox Substance ID: DTXSID00593386
• Nikkaji Number: J3.452.942F
• Wikidata: Q82487868

Synonyms:2,3-Dihydro-1H-benzo[f]isoindole;6247-15-0;SCHEMBL6221770;DTXSID00593386;AKOS015840963

Chemical Property of 2,3-Dihydro-1H-benzo[f]isoindole

Chemical Property:

• Vapor Pressure: 0.00032mmHg at 25°C
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 169.089149355
• Heavy Atom Count: 13
• Complexity: 170

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C2=CC3=CC=CC=C3C=C2CN1

Technology Process of 2,3-Dihydro-1H-benzo[f]isoindole

There total 4 articles about 2,3-Dihydro-1H-benzo[f]isoindole 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: 97.0%

tert-butyl 1,3-dihydro-2H-benzo[f]isoindole-2-carboxylate → Benz[f]isoindoline (6247-15-0)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 0 - 20 ℃; for 12h;

DOI:10.1021/jacs.8b09974

Reference yield: 43.0%

2,3-Naphthalimide (4379-54-8) → Benz[f]isoindoline (6247-15-0)

Guidance literature:

With BH₃-THF; In tetrahydrofuran; methanol; CHC₁₃;

Reference yield:

2,3-di(bromomethyl)naphthalene (38998-33-3) → Benz[f]isoindoline (6247-15-0)

Guidance literature:

With methanol; ammonia;

upstream raw materials:

2,3-di(bromomethyl)naphthalene

2,3-Naphthalimide

2,3-dimethylnaphthalene

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