Bicyclo[4.2.0]octa-1,3,5-triene, 7-iodo-

Base Information

• Chemical Name: Bicyclo[4.2.0]octa-1,3,5-triene, 7-iodo-
• CAS No.: 78329-06-3
• Molecular Formula: C8H7I
• Molecular Weight: 230.048
• DSSTox Substance ID: DTXSID10451327

Synonyms:78329-06-3;Bicyclo[4.2.0]octa-1,3,5-triene, 7-iodo-;DTXSID10451327;2-iodo-1,2-dihydrocyclobutabenzene

Chemical Property of Bicyclo[4.2.0]octa-1,3,5-triene, 7-iodo-

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 229.95925
• Heavy Atom Count: 9
• Complexity: 111

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C2=CC=CC=C21)I

Technology Process of Bicyclo[4.2.0]octa-1,3,5-triene, 7-iodo-

There total 1 articles about Bicyclo[4.2.0]octa-1,3,5-triene, 7-iodo- 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:

1-bromobenzocyclobutene (21120-91-2) → 1-iodobenzocyclobutene (78329-06-3)

Guidance literature:

With sodium iodide; In acetone; for 12h; Yield given; Heating;

DOI:10.1021/jo00332a035

Reference yield: 67.0%

1-iodobenzocyclobutene (78329-06-3) + methyl 2-methoxycarbonyl-3-[(1R,5S)-1-(p-bromophenyl)-2-acetyl-5-vinylcyclopentan-1-yl]-propanoate ethylene ketal → methyl 2-benzocyclobutenyl-2-methoxycarbonyl-3-[(1R,5S)-1-(p-bromophenyl)-2-acetyl-5-vinylcyclopentan-1-yl]-propanoate ethylene ketal

Guidance literature:

With CsCO₃; In acetone; for 46h; Heating;

DOI:10.1016/S0040-4020(98)00432-3

Reference yield: 27.0%

1-iodobenzocyclobutene (78329-06-3) + 2-(1-Phenyl-2,5-divinyl-cyclopentylmethyl)-malonic acid dimethyl ester → 2-Bicyclo[4.2.0]octa-1(6),2,4-trien-7-yl-2-((2S,5S)-1-phenyl-2,5-divinyl-cyclopentylmethyl)-malonic acid dimethyl ester + 2-((1S,2R,5S)-1-Phenyl-2,5-divinyl-cyclopentylmethyl)-malonic acid dimethyl ester

Guidance literature:

With caesium carbonate; In acetone; for 36h; Heating;

DOI:10.1016/S0040-4020(98)00193-8

upstream raw materials:

1-bromobenzocyclobutene

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