|
Refractive_Index:
|
1.562-1.565
|
|
Flash_Point:
|
79.4 °C
|
|
LogP:
|
2.10970
|
|
Bolling_Point:
|
207 °C
|
|
FW:
|
121.18000
|
|
PSA:
|
12.03000
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 12 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :806 ', '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']
|
|
MF:
|
C8H11N
|
|
Exact_Mass:
|
121.08900
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 4068 ', '2 . Molar volume 1251 ', '3 . Parachor （902K）3038 ', '4 . Surface tension 347 ', '5 . Polarizability 1612']
|
|
Density:
|
0.97
|
|
More_Info:
|
['1. Appearance 浅Yellow 油状Liquid 。 ', '2. Melting point（℃）1195 ', '3. Boiling point（℃）206~207 ', '4 . Flash point（ºC）794 ', '5 相对. Density(d204) 09709 ', '6 . Refractive index(n20D)15649 ', '7 . Solubility Insoluble in Water ，Soluble in 丙酮，混Soluble in Ethanol Ethyl ether 。']
|
