1,3-Cyclohexanedione


Catalog No:   FT-0606599

CAS No:   504-02-9

  • Molecular Formula:  112.13
  • Formula Weight: C6H8O2
  • Inchl Key: HJSLFCCWAKVHIW-UHFFFAOYSA-N
  • Inchl: InChI=1S/C6H8O2/c7-5-2-1-3-6(8)4-5/h1-4H2

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
FW: 112.127
CAS: 504-02-9
Melting_Point: 101-105 °C(lit.)
Bolling_Point: 235.1±23.0 °C at 760 mmHg
MF: C6H8O2
Product_Name: 1,3-Cyclohexanedione
Flash_Point: 85.7±19.6 °C
Density: 1.1±0.1 g/cm3
FW: 112.127
MF: C6H8O2
Water_Solubility: soluble
Refractive_Index: 1.474
Vapor_Pressure: 0.1±0.5 mmHg at 25°C
Bolling_Point: 235.1±23.0 °C at 760 mmHg
Exact_Mass: 112.052429
PSA: 34.14000
Computational_Chemistry: ['1. XlogP :0 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :5 ', '6. TPSA 341 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :113 ', '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']
Molecular_Structure: ['1 . Molar refractive index 2793 ', '2 . Molar volume (m3/mol)994 ', '3 . Parachor (902K)2510 ', '4 . Surface tension 405 ', '5 . Polarizability (10 -24cm 3)1107']
LogP: -0.89
Melting_Point: 101-105 °C(lit.)
Flash_Point: 85.7±19.6 °C
Density: 1.1±0.1 g/cm3
More_Info: ['1 . Appearance Colourless Solid ', '2 . Density(g/ cm3,25/4℃)11 ', '3 . Relative vapor density(g/cm3,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºF)Unknow ', '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,60ºC)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 Soluble in Water ']
Personal_Protective_Equipment: Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RTECS: GV0350000
HS_Code: 2914399090
Safety_Statements: S24/25
RIDADR: NONH for all modes of transport
WGK_Germany: 3

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