|
FW:
|
91.109
|
|
MF:
|
C3H9NO2
|
|
Water_Solubility:
|
soluble
|
|
Refractive_Index:
|
1.496
|
|
Vapor_Pressure:
|
0.0±1.2 mmHg at 25°C
|
|
Bolling_Point:
|
266.7±20.0 °C at 760 mmHg
|
|
Exact_Mass:
|
91.063332
|
|
PSA:
|
66.48000
|
|
Computational_Chemistry:
|
['1. XlogP :-2 ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 665 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :32 ', '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']
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 2251 ', '2 . Molar volume （m3/mol）771 ', '3 . Parachor （902K）2113 ', '4 . Surface tension 564 ', '5 . Polarizability （10 -24cm 3）892']
|
|
LogP:
|
-1.98
|
|
Flash_Point:
|
115.1±21.8 °C
|
|
Density:
|
1.2±0.1 g/cm3
|
|
More_Info:
|
['物性数据 1 . Appearance 高粘稠性Liquid ', '2 相对. Density11752 ', '3 折光率14920 ', '4 . Flash point（℃）＞112 ', '5 . Boiling point（ºC,9853kpa）265']
|
