|
Refractive_Index:
|
1.623
|
|
Vapor_Pressure:
|
0.0±6.0 mmHg at 25°C
|
|
Flash_Point:
|
288.9±26.4 °C
|
|
LogP:
|
-4.34
|
|
Bolling_Point:
|
774.5±60.0 °C at 760 mmHg
|
|
Water_Solubility:
|
Freely soluble (250 g/L) (25 ºC)
|
|
PSA:
|
189.53000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 7080 ', '2 . Molar volume 1936 ', '3 . Parachor （902K）6283 ', '4 . Surface tension 1108 ', '5 . Polarizability 2806']
|
|
Computational_Chemistry:
|
['1 . XlogP -47 ', '2 . Hydrogen Bond Donor Count 8 ', '3 . Hydrogen Bond Acceptor Count 11 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count ', '6 . TPSA 190 ', '7 . Heavy Atom Count 23 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 382 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 10 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
|
|
Melting_Point:
|
120 ºC
|
|
MF:
|
C12H22O11
|
|
Exact_Mass:
|
342.116211
|
|
FW:
|
342.297
|
|
Density:
|
1.68±0.1 g/cm3 (20 ºC 760 Torr)
|
|
More_Info:
|
['1 . Appearance 为White Solid 粉末 ', '2 . Density（g/ m3,25/4℃）Unknow ', '3 . Relative vapor density（g/cm3,Atmosphere =1）Unknow ', '4 . Melting point（ºC）155-160 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index113° ', '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 易Soluble in Water ']
|
