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Refractive_Index:
|
1.502
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Vapor_Pressure:
|
0.0±0.4 mmHg at 25°C
|
|
Flash_Point:
|
100.0±0.0 °C
|
|
LogP:
|
2.26
|
|
Bolling_Point:
|
238.5±0.0 °C at 760 mmHg
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|
PSA:
|
26.30000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 4684 ', '2 . Molar volume 1587 ', '3 . Parachor （902K）3881 ', '4 . Surface tension 357 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 1856']
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|
Computational_Chemistry:
|
['1. XlogP :N/A ', '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 :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :137 ', '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:
|
C10H12O2
|
|
Exact_Mass:
|
164.083725
|
|
FW:
|
164.201
|
|
Density:
|
1.0±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,25℃）1043 ', '3相对. Density（25℃，4℃）09841871 ', '4 相对. Density（20℃，4℃）10432 ', '5 . Boiling point（ºC）232755 ', '6 常温. Refractive index（n20）15022 ', '7 . Refractive index1502 ', '8 . Flash point（ºC）100 ', '9 常温. Refractive index（n25）14995 ', '10 . Spontaneous ignition point or ignition temperature（ºC）: Unknow ', '11 . Vapor pressure（mmHg,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa, ºC）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']
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