|
Refractive_Index:
|
n20/D 1.374(lit.)
|
|
Flash_Point:
|
33 °F
|
|
LogP:
|
0.79520
|
|
Bolling_Point:
|
50-51 °C(lit.)
|
|
Water_Solubility:
|
58 g/L (20 ºC)
|
|
FW:
|
72.10570
|
|
PSA:
|
12.53000
|
|
Computational_Chemistry:
|
['1. XlogP :05 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 125 ', '7. Heavy Atom Count :5 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :476 ', '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:
|
C4H8O
|
|
Exact_Mass:
|
72.05750
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 2015 ', '2 . Molar volume 826 ', '3 . Parachor （902K）1877 ', '4 . Surface tension 265 ', '5 . Polarizability 789']
|
|
Density:
|
0.812 g/mL at 25 °C(lit.)
|
|
More_Info:
|
['一物性数据 ', '1 . Density 0808 ', '2 . Refractive index1371-1373 ', '3 . Flash point（℃）-32 ', '4 . Boiling point（ºC）52 ', '5 常温. Refractive index（n20）1371222 ', '6 相对. Density（20℃，4℃）086400']
|
