|
MF:
|
C6H10O4
|
|
Bolling_Point:
|
257.8±23.0 °C at 760 mmHg
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|
Exact_Mass:
|
146.057907
|
|
More_Info:
|
['1 . Appearance Unknow。 ', '2 . Density（g/mL,25℃）1141 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）248 ', '6 . Boiling point（ºC,11mmHg）Unknow ', '7 . Refractive index(n 20/D) 1432 ', '8 . Flash point（ºF）>230 ', '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 Unknow']
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|
PSA:
|
63.60000
|
|
Flash_Point:
|
106.2±16.1 °C
|
|
Computational_Chemistry:
|
['1 . XlogP 05 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 5 ', '5 . TPSA 636 ', '6 . Heavy Atom Count 10 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 130 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
|
|
Density:
|
1.2±0.1 g/cm3
|
|
Molecular_Structure:
|
['1. Molar refractive index 3318 ', '2. Molar volume 1256 ', '3. Parachor （902K）3173 ', '4. Surface tension 406 ', '5. Dielectric constant N/A ', '6. Polarizability 1315 ', '7. Single isotope mass 146057909 Da ', '8. Nominal mass 146 Da ', '9. Average mass 1461412 Da']
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|
Vapor_Pressure:
|
0.0±1.1 mmHg at 25°C
|
|
FW:
|
146.141
|
|
LogP:
|
0.32
|
|
Refractive_Index:
|
1.441
|
