|
Refractive_Index:
|
1.496
|
|
Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
|
|
Flash_Point:
|
101.8±17.1 °C
|
|
LogP:
|
3.00
|
|
Bolling_Point:
|
258.2±9.0 °C at 760 mmHg
|
|
PSA:
|
26.30000
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 5607 ', '2 . Molar volume （m3/mol）1918 ', '3 . Parachor （902K）4628 ', '4 . Surface tension 339 ', '5 . Polarizability 2222']
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|
Computational_Chemistry:
|
['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :191 ', '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:
|
C12H16O2
|
|
Exact_Mass:
|
192.115036
|
|
FW:
|
192.254
|
|
Density:
|
1.0±0.1 g/cm3
|
|
More_Info:
|
['一物性数据 ', '1. Appearance Colourless 透明Liquid ，似花香果香香气。 ', '2. Density（g/mL ,25/4℃）0998 ', '3. Refractive index（nD20）14925 ', '4. Flash point（°F）206 ', '5. Boiling point（ºC）250 ', '6. Solubility Soluble in Ethanol 大多数非挥发性油and 矿物油，微Soluble in 丙二醇，Insoluble in 甘油and Water 。']
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