|
FW:
|
148.202
|
|
MF:
|
C10H12O
|
|
Refractive_Index:
|
1.505
|
|
Vapor_Pressure:
|
0.2±0.4 mmHg at 25°C
|
|
Bolling_Point:
|
216.0±0.0 °C at 760 mmHg
|
|
Exact_Mass:
|
148.088821
|
|
PSA:
|
9.23000
|
|
Computational_Chemistry:
|
['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 :N/A ', '6. TPSA 92 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :112 ', '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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|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 4683 ', '2 . Molar volume 1578 ', '3 . Parachor （902K）3693 ', '4 . Surface tension 299 ', '5 . Polarizability 1856']
|
|
LogP:
|
3.15
|
|
Flash_Point:
|
81.1±0.0 °C
|
|
Density:
|
0.9±0.1 g/cm3
|
|
More_Info:
|
['一物性数据 ', '1 . Appearance Colourless Liquid ，有茴香and 草香香气。 ', '2. Density（g/mL,25/4℃）0965 ', '3. Refractive index(n20D) 15195 ', '4. Flash point（ºC） 81 ', '5. Boiling point（ºC,Atmospheric pressure）216 ，102ºC(2133pa) ', '6 . Solubility Soluble in Ethanol and 氯仿，Insoluble in Water ', '7 相对. Density（20℃，4℃）09612 ', '8 液相标准热熔(J·mol-1·K-1)3535']
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