Molecular_Structure:
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['1 . Molar refractive index 6170 ', '2 . Molar volume 2036 ', '3 . Parachor (902K)4903 ', '4 . Surface tension 336 ', '5 . Dielectric constant 无可用 ', '6 偶极距(10-24cm3)无可用 ', '7 . Polarizability 2446']
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Computational_Chemistry:
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['1 . XlogP 29 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 1 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 174 ', '7 . Heavy Atom Count 14 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 292 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 1 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
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More_Info:
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['1 . Appearance 浅黄to Colourless Liquid ,有紫罗兰香味,但木香香韵更为突出。 ', '2 . Density(g/mL,25℃)0945 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)-49 ', '5 . Boiling point(ºC,Atmospheric pressure)124(1333pa) ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive index(n 20/D) 152 ', '8 . Flash point(ºC)112 ', '9 . Specific rotation(º) Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,441ºC)Unknow ', '12 . Saturated vapor pressure(kPa,20 ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(MPa)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 Ethanol Ethyl ether 丙二醇,微Soluble in Water and 甘油']
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