|
Refractive_Index:
|
1.489
|
|
Vapor_Pressure:
|
0.5±0.3 mmHg at 25°C
|
|
Flash_Point:
|
69.4±0.0 °C
|
|
LogP:
|
2.24
|
|
Bolling_Point:
|
199.7±0.0 °C at 760 mmHg
|
|
Water_Solubility:
|
decomposes
|
|
PSA:
|
18.46000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 4392 ', '2 . Molar volume 1522 ', '3 . Parachor （902K）3616 ', '4 . Surface tension : 318 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 1741']
|
|
Computational_Chemistry:
|
['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 185 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :937 ', '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:
|
87-89ºC
|
|
MF:
|
C9H12O2
|
|
Exact_Mass:
|
152.083725
|
|
FW:
|
152.190
|
|
Density:
|
1.0±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless 透明Liquid ', '2 . Density（g/mL,25℃）1014 ', '3 . Melting point（ºC）87-89 ', '4 . Boiling point（ºC,18mmHg）87-89 ', '5 . Refractive index(n20/D)1493 ', '6 . Flash point（ºF）157 ', '7 . Solubility 反应']
|
