|
Refractive_Index:
|
1.457
|
|
Vapor_Pressure:
|
0.0±1.0 mmHg at 25°C
|
|
Flash_Point:
|
84.6±18.5 °C
|
|
LogP:
|
10.29
|
|
Bolling_Point:
|
422.9±14.0 °C at 760 mmHg
|
|
FW:
|
352.594
|
|
PSA:
|
26.30000
|
|
Computational_Chemistry:
|
['1 . XlogP 98 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 20 ', '5 . TPSA 263 ', '6 . Heavy Atom Count 25 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 297 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 1 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
|
|
MF:
|
C23H44O2
|
|
Exact_Mass:
|
352.334137
|
|
Molecular_Structure:
|
['1 . Molar refractive index 11043 ', '2 . Molar volume （m3/mol）4052 ', '3 . Parachor （902K）9591 ', '4 . Surface tension 313 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 4378']
|
|
Density:
|
0.9±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless Liquid 2 . Density（ g/mL,20 ℃ ） 0870 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,2mmHg）172-175 ', '7 . Refractive index(n20/D)1456 ', '8 . Flash point（ºC）33 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,20ºC）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 Unknow']
|
