|
Refractive_Index:
|
1.552
|
|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
|
|
Flash_Point:
|
115.8±15.2 °C
|
|
LogP:
|
1.39
|
|
Bolling_Point:
|
277.0±23.0 °C at 760 mmHg
|
|
PSA:
|
37.30000
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 3816 ', '2 . Molar volume 1193 ', '3 . Parachor （902K）3074 ', '4 . Surface tension 439 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', ' 7. Polarizability 1512']
|
|
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 :6 ', '6. TPSA 373 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :131 ', '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:
|
90-95 °C(lit.)
|
|
MF:
|
C8H8O2
|
|
Exact_Mass:
|
136.052429
|
|
FW:
|
136.148
|
|
Density:
|
1.1±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance 针状体结晶 ', '2 相对. Density（109℃）1099 ', '3. Refractive index (n109D) 15348 ', '4 . Melting point（℃）95-97 ', '5 . Boiling point（ºC）296 ', '6 . Boiling point（ºC,067kpa）153']
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