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Molecular_Structure:
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['1 . Molar refractive index 5566 ', '2 . Molar volume （m3/mol）1696 ', '3 . Parachor （902K）4315 ', '4 . Surface tension 418 ', '5 . Polarizability 2206']
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|
Flash_Point:
|
>230 °F
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|
Refractive_Index:
|
1.5750
|
|
FW:
|
176.25800
|
|
Density:
|
1.046 g/mL at 25 °C(lit.)
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|
Bolling_Point:
|
111-112 °C0.55 mm Hg(lit.)
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|
Computational_Chemistry:
|
['1. XlogP :2 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 241 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :141 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :1 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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|
LogP:
|
2.25230
|
|
Melting_Point:
|
19°C
|
|
PSA:
|
24.06000
|
|
MF:
|
C11H16N2
|
|
More_Info:
|
['1 . Appearance Colourless to Yellow 透明Liquid 。 ', '2 . Density（g/mL,25/4℃）1046 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）19 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）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 与Water 混溶。']
|
|
Exact_Mass:
|
176.13100
|
