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Refractive_Index:
|
1.564
|
|
Vapor_Pressure:
|
0.0±1.1 mmHg at 25°C
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|
Flash_Point:
|
120.8±16.2 °C
|
|
LogP:
|
1.31
|
|
Bolling_Point:
|
266.7±19.0 °C at 760 mmHg
|
|
FW:
|
138.164
|
|
PSA:
|
37.30000
|
|
Computational_Chemistry:
|
['1. XlogP :12 ', '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 373 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :195 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :3 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
|
|
MF:
|
C8H10O2
|
|
Exact_Mass:
|
138.068085
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 3604 ', '2 . Molar volume （m3/mol）1107 ', '3 . Parachor （902K）2950 ', '4 . Surface tension 503 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 1428']
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|
Density:
|
1.2±0.1 g/cm3
|
|
More_Info:
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['1 . Density1129 ', '2 . Refractive index1494 ', '3 . Flash point（℃）>110 ', ' 4 . Boiling point（ºC,14mmHg）136~138 ', '5 Water 溶性略Soluble in Water ']
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