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Refractive_Index:
|
1.494
|
|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
|
|
Flash_Point:
|
103.2±17.1 °C
|
|
LogP:
|
3.91
|
|
Bolling_Point:
|
274.8±9.0 °C at 760 mmHg
|
|
PSA:
|
26.30000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 6069 ', '2 . Molar volume 2086 ', '3 . Parachor （902K）5049 ', '4 . Surface tension 342 ', '5 . Polarizability 2406']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :181 ', '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']
|
|
MF:
|
C13H18O2
|
|
Exact_Mass:
|
206.130676
|
|
FW:
|
206.281
|
|
Density:
|
1.0±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless 油状Liquid ，具有类似可可豆的香气及类似淡桦木焦油的底香气。 ', '2 . Density（g/mL,25/4℃） 0982 ', '3 . Melting point（ºC）248 ', '4 . Boiling point（ºC,Atmospheric pressure）268 ºC ', '5 . Refractive index（nD20）1485～1487 ', '6 . Flash point（ºC）120 ºC ', '7. Solubility Insoluble in Water ，Soluble in 油and 醇，以13Soluble in 80% Ethanol 。']
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