4096-95-1

Basic information

• Product Name: bicyclo[3.2.1]octa-2,6-diene
• Synonyms: Bicyclo(3.2.1)octa-2,6-diene; Bicyclo[3.2.1]octa-2,6-diene
• CAS NO: 4096-95-1
• Molecular Formula: C₈H₁₀
• Molecular Weight: 106.165
• Mol File: 4096-95-1.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 146.5°C at 760 mmHg
• Flash Point: 20.4°C
• Density: 0.969g/cm³
• Vapor Pressure: 5.84mmHg at 25°C
• Refractive Index: 1.535
• CAS DataBase Reference: bicyclo[3.2.1]octa-2,6-diene(CAS DataBase Reference)
• NIST Chemistry Reference: bicyclo[3.2.1]octa-2,6-diene(4096-95-1)
• EPA Substance Registry System: bicyclo[3.2.1]octa-2,6-diene(4096-95-1)

Safety Data

• Hazardous Substances Data: 4096-95-1(Hazardous Substances Data)

Upstream product

• 80976-41-6 bicyclo<3.2.1>octa-3,6-dien-2-one tosylhydrazone 
• 80976-42-7 bicyclo<3.2.1>octa-3,6-dien-2-one tosylhydrazone lithium salt 
• 3635-95-8 exo-tricyclo<3.2.1.0^2,4>oct-6-ene 
• 3635-94-7 endo-tricyclo<3.2.1.0^2,4>oct-6-ene 
• 765-72-0 tetracyclo<3.3.0.0^2,8.0^4,6>octane 

Downstream Products

• 79769-96-3 C₁₆H₁₅N₃O₂ 
• 79770-00-6 C₁₆H₁₅N₃O₂ 
• 79769-98-5 C₁₆H₁₅N₃O₂ 
• 74-85-1 ethene 
• 1192-86-5 1-ethenyl-1,3-cyclohexadiene 
• 110269-92-6 bicyclo<3.3.0>-2,6-octadiene 
• 542-92-7 cyclopenta-1,3-diene 
• 74-99-7 prop-1-yne 
• 71-43-2 benzene 

Relevant articles and documents

An Experimental Approach to the C8H10 Hypersurface. Kinetic and Thermochemical Investigations on a Formally Forbidden Ground-state <2? + 2?) Cycloaddition

The C8H10 hydrocarbons 1, 3, 4, and 6 have been thermolyzed in a static system and the Arrhenius parameters have been obtained.Calorimetric measurements have been carried out to determine the heats of formation.From these data an experimental energy hypersurface is constructed which shows the following remarkable features: 1) The ground-state energy of endo-1 is higher than that of exo-4 by 8 kcal/mol. 2) The predominant reaction pathway of endo-1 is the formally forbidden 6 and 4->3 are the same, the reaction yielding 6 is faster due to a sizeably higher A factor. 4) The tetracycle 3 chooses the microscopic reverse pathway, i.e. its thermolysis proceeds via exo-4 to give the diene 6.