Bicyclo[3.2.2]nona-6,8-dien-2-one

Base Information

• Chemical Name: Bicyclo[3.2.2]nona-6,8-dien-2-one
• CAS No.: 26760-27-0
• Molecular Formula: C9H10O
• Molecular Weight: 134.178
• DSSTox Substance ID: DTXSID80498926
• Wikidata: Q82349289

Synonyms:Bicyclo[3.2.2]nona-6,8-dien-2-one;26760-27-0;SCHEMBL9007579;DTXSID80498926

Chemical Property of Bicyclo[3.2.2]nona-6,8-dien-2-one

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 134.073164938
• Heavy Atom Count: 10
• Complexity: 199

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)C2C=CC1C=C2

Technology Process of Bicyclo[3.2.2]nona-6,8-dien-2-one

There total 3 articles about Bicyclo[3.2.2]nona-6,8-dien-2-one 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:

2,3,8,9-tetrahydroinden-1-one (68752-08-9) → 3-phenyl-propionaldehyde (104-53-0) + Bicyclo<3.2.2>nona-6,8-dien-2-on (26760-27-0) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1)

Guidance literature:

In acetonitrile; Irradiation; 300 nm;

DOI:10.1016/S0040-4039(01)83941-1

Reference yield:

2,3,8,9-tetrahydroinden-1-one (68752-08-9) → 3-phenyl-propionaldehyde (104-53-0) + Bicyclo<3.2.2>nona-6,8-dien-2-on (26760-27-0) + 2a,2b,4,5,5a,5b-Hexahydro-cyclopropa[cd]inden-3-one (75107-72-1) + Bicyclo<4.2.0>-octa-2,4-dien (3725-28-8)

Guidance literature:

In acetonitrile; Further byproducts given; Irradiation; 254 nm;

DOI:10.1016/S0040-4039(01)83941-1

Reference yield:

2,3,8,9-tetrahydroinden-1-one (68752-08-9) → 3-phenyl-propionaldehyde (104-53-0) + (1Z,3Z,5Z)-Cycloocta-1,3,5-triene (1871-52-9) + Bicyclo<3.2.2>nona-6,8-dien-2-on (26760-27-0) + 2a,2b,4,5,5a,5b-Hexahydro-cyclopropa[cd]inden-3-one (75107-72-1) + Bicyclo<4.2.0>-octa-2,4-dien (3725-28-8) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1)

Guidance literature:

In acetonitrile; Mechanism; Irradiation; effect of wawe length to the product distribution and yield discussed;

DOI:10.1016/S0040-4039(01)83941-1

upstream raw materials:

2,3,8,9-tetrahydroinden-1-one

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