|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :617 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
|
|
More_Info:
|
['1 . Appearance Colourless Liquid 。 ', '2 相对. Density（g/mL,20/4℃）08231 ', '3 相对. Density（25℃，4℃）08195 ', '4 . Melting point（ºC）-35 ', '5 . Boiling point（ºC,Atmospheric pressure）1985 ', '6 常温. Refractive index（n20）14310 ', '7 . Refractive index（20ºC）1431 ', '8 . Flash point（ºC）96 ', '9 常温. Refractive index（n25）14290 ', '10 . Critical temperature（ºC）37645 ', '11 . Critical pressure（MPa）253 ', '12临界. Density（g·cm-3）0251 ', '13 临界体积（cm3·mol-1）575 ', '14 临界压缩因子0269 ', '15 偏心因子0890 ', '16 液相标准热熔(J·mol-1·K-1)3470 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 能与 Ethanol Ethyl ether 相混溶，Insoluble in Water 。']
|
