|
Refractive_Index:
|
1.571-1.574
|
|
Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
|
|
Flash_Point:
|
116 ºC
|
|
LogP:
|
1.70
|
|
Bolling_Point:
|
248-249 ºC
|
|
PSA:
|
26.30000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 3968 ', '2 . Molar volume 1251 ', '3 . Parachor （902K）3090 ', '4 . Surface tension 372 ', '5 . Polarizability 1573']
|
|
Vapor_Density:
|
4.7 (vs air)
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :104 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '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:
|
-1 °C
|
|
MF:
|
C8H8O2
|
|
Exact_Mass:
|
136.052429
|
|
FW:
|
136.148
|
|
Density:
|
1.121
|
|
More_Info:
|
['1 . Appearance Colourless 油状Liquid ', '2 相对. Density1119 g/cm3 ', '3 . Melting point（℃）0 ', '4 . Boiling point（℃）248 ', '5 . Flash point（℃）108 ', '6 燃点（℃，开杯）1178 ', '7 . Solubility 微Soluble in Water 能与 Ethanol Ethyl ether 混溶，易Soluble in 丙酮and 氯仿，Soluble in 苯。 ', '8 相对. Density（20℃，4℃）1119115 ', '9 相对. Density（25℃，4℃）1029131 ', '10 常温. Refractive index（n20）15731 ', '11 气相标准. Combustion heat(焓)(kJ·mol-1)-40887 ', '12 气相标准声称热(焓)( kJ·mol-1) -2027 ', '13 液相标准. Combustion heat(焓)(kJ·mol-1)-40242 ', '14 液相标准声称热(焓)( kJ·mol-1)-2672']
|
