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Molecular_Structure:
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['1. Molar refractive index 9202 ', '2. Molar volume 2378 ', '3. Parachor （902K）682 ', '4. Surface tension 676 ', '5. Dielectric constant N/A ', '6. Polarizability 3648 ', '7. Single isotope mass 326199428Da ', '8. Nominal mass 326Da ', '9. Average mass 3264326Da']
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LogP:
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1.55740
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Flash_Point:
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285.155ºC
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Refractive_Index:
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1.701
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FW:
|
326.43300
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Density:
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1.373g/cm3
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Bolling_Point:
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519.406ºC at 760 mmHg
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Computational_Chemistry:
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['1. XlogP 18 ', '2. Hydrogen Bond Donor Count 2 ', '3. Hydrogen Bond Acceptor Count 4 ', '4. Rotatable Bond Count 1 ', '5. Isotope Atom Count N/A ', '6. TPSA 469 ', '7. Heavy Atom Count 24 ', '8. Topological Polar Surface Area 0 ', '9. Complexity 570 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 8 ', '12. Undefined Atom Stereocenter Count 1 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']
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Melting_Point:
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189ºC
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|
PSA:
|
46.94000
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MF:
|
C20H26N2O2
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|
More_Info:
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['1 . Appearance 淡琥珀色四角形结晶。无气味。味苦。 ', '2 . Density（g/mL,25/4℃） Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）205-207 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º，C=04，氯仿中）+131 ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Soluble in 甲醇 Ethanol Ethyl ether and 氯仿，微Soluble in Water 。']
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Exact_Mass:
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326.19900
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