|
Refractive_Index:
|
n20/D 1.4055(lit.)
|
|
Flash_Point:
|
36 °F
|
|
LogP:
|
1.83400
|
|
Bolling_Point:
|
89-91 °C(lit.)
|
|
Water_Solubility:
|
soluble
|
|
PSA:
|
26.02000
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 2870 ', '2 . Molar volume （m3/mol）1151 ', '3 . Parachor （902K）2574 ', '4 . Surface tension 250 ', '5 . Polarizability （10 -24cm 3）1138']
|
|
Computational_Chemistry:
|
['1. XlogP :11 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 26 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :231 ', '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:
|
C5H13N
|
|
Exact_Mass:
|
87.10480
|
|
FW:
|
87.16340
|
|
Density:
|
0.748 g/mL at 25 °C(lit.)
|
|
More_Info:
|
['物性数据 1 . Density（ g/mL ,25/4 ℃） 0748 ', '2 . Refractive index（nD20）14055 ', '3 . Flash point（℃）2 ', '4 . Boiling point（ºC） 89-91 ', '5 . Solubility Soluble in Water ']
|
