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Refractive_Index:
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1.541
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|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
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|
Flash_Point:
|
115.1±13.3 °C
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|
LogP:
|
1.34
|
|
Bolling_Point:
|
285.0±0.0 °C at 760 mmHg
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|
Water_Solubility:
|
0.1-0.5 g/100 mL at 17 ºC
|
|
PSA:
|
46.53000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 3912 ', '2 . Molar volume （m3/mol）1245 ', '3 . Parachor （902K）3255 ', '4 . Surface tension 466 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 1551']
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|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 465 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :127 ', '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']
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|
Melting_Point:
|
98-100 °C(lit.)
|
|
MF:
|
C8H8O3
|
|
Exact_Mass:
|
152.047348
|
|
FW:
|
152.147
|
|
Density:
|
1.2±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance White 针状结晶 2 . Flash point（ ℃ ）165 ', '3 . Melting point（℃）98-101 ', '4 . Boiling point（ºC）285 ', '5 Water 溶性（g/100mL,°C）01-05']
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