|
FW:
|
74.078
|
|
MF:
|
C3H6O2
|
|
Refractive_Index:
|
1.455
|
|
Vapor_Pressure:
|
0.7±0.7 mmHg at 25°C
|
|
Bolling_Point:
|
162.4±8.0 °C at 760 mmHg
|
|
Exact_Mass:
|
74.036781
|
|
PSA:
|
32.76000
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 328 ', '7. Heavy Atom Count :5 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :359 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
|
|
Molecular_Structure:
|
['1 . Molar refractive index 1705 ', '2 . Molar volume 628 ', '3 . Parachor （902K）1657 ', '4 . Surface tension 483 ', '5 . Polarizability 676']
|
|
LogP:
|
-0.95
|
|
Melting_Point:
|
-54ºC
|
|
Flash_Point:
|
81.1±0.0 °C
|
|
Density:
|
1.2±0.1 g/cm3
|
|
More_Info:
|
['1性质Colourless 并近于无臭的Liquid ', '2. Melting point（℃）-53 ', '3. Boiling point（01MPa）162～163℃（分解） 54℃（133kPa） ', '4相对. Density（kg/ml,20℃）1105 ', '5. Refractive index14311 ', '6. Flash point（℃）715 ', '7燃点（℃）415 ', '8粘度（20℃）400mPa·s ', '9表面张力（mN/m，22℃）453 ', '10. Solubility 能与Water 低碳醇酯酮 Ethyl ether 苯甲苯苯乙烯氯苯氯甲烷氯仿三氯乙烯二甲基甲酰胺二甲亚砜及乙腈完全互溶，部分Soluble in 二甲苯四氯乙烯1,1,1-三氯乙烷，几乎Insoluble in 脂肪族and 脂环族烃类。']
|
