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Bolling_Point:
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109-112 °C15 mm Hg(lit.)
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Vapor_Pressure:
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0.075mmHg at 25°C
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More_Info:
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['1 . Boiling point（ºC）228 ', '2 相对. Density（20℃，4℃）0988 ', '3 相对. Density（25℃，4℃）09717404 ', '4 常温. Refractive index（n20）1152 ', '5 常温. Refractive index（n25）15096 ', '6 . Flash point（ºC）90 ', '7 . Appearance Colourless Liquid 。 ', '8 . Solubility Insoluble in Water ，Soluble in Ethanol 四氯化碳丙酮，与 Ethyl ether 互溶。']
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LogP:
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2.20820
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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :3 ', '6. TPSA 171 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :123 ', '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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Exact_Mass:
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148.08900
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MF:
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C10H12O
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Density:
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0.998 g/mL at 25 °C(lit.)
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Refractive_Index:
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n20/D 1.512(lit.)
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PSA:
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17.07000
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Flash_Point:
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195 °F
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Molecular_Structure:
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['1. Molar refractive index 4509 ', '2. Molar volume 1523 ', '3. Parachor （902K）3685 ', '4. Surface tension 341 ', '5. Dielectric constant N/A ', '6. Polarizability 1787 ', '7. Single isotope mass 148088815 Da ', '8. Nominal mass 148 Da ', '9. Average mass 1482017 Da']
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FW:
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148.20200
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