Melting_Point:	-7ºC
CAS:	539-80-0
MF:	C7H6O
Flash_Point:	85.6ºC
Product_Name:	cyclohepta-2,4,6-trien-1-one
Density:	1.094
FW:	106.12200
Bolling_Point:	113ºC (15 torr)

Refractive_Index:	n20/D 1.615(lit.)
Flash_Point:	85.6ºC
LogP:	1.04680
Bolling_Point:	113ºC (15 torr)
PSA:	17.07000
Molecular_Structure:	['1 . Molar refractive index 3122 ', '2 . Molar volume （m3/mol）1005 ', '3 . Parachor （902K）2487 ', '4 . Surface tension 374 ', '5 . Polarizability 1237']
Computational_Chemistry:	['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 171 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :155 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	-7ºC
MF:	C7H6O
Exact_Mass:	106.04200
FW:	106.12200
Density:	1.094
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/ cm3,25/4℃）1091 ', '3 . Relative vapor density（g/cm3,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-7 ', '5 . Boiling point（ºC,Atmospheric pressure）113 ', '6 . Boiling point（ºC,8kPa）Unknow ', '7 . Refractive index1615 ', '8 . Flash point（ºC）110 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,551ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']