|
Vapor_Density:
|
3.9 (vs air)
|
|
MF:
|
C6H10O2
|
|
Bolling_Point:
|
125.0±9.0 °C at 760 mmHg
|
|
Exact_Mass:
|
114.068077
|
|
More_Info:
|
['1. Appearance Yellow 透明Liquid ，甜的浓烈的乳脂奶香，脂肪腻气比丁酮浓。 ', '2. Refractive index（n/D20）1411-1413 ', '3. Flash point（℃）28 ', '4 . Melting point（℃）-30 ', '5. Boiling point（ºC） 128 ', '6蒸汽压（mmHg，20ºC）10 ', '7 蒸汽. Density39（Atmosphere =1） ', '8. Solubility 微Soluble in Water ，可Soluble in 丙二醇 Ethanol and 多种脂肪油类有奶油and 乳酪的味道。']
|
|
Melting_Point:
|
-30 °C
|
|
PSA:
|
34.14000
|
|
Flash_Point:
|
32.8±4.4 °C
|
|
Refractive_Index:
|
1.406
|
|
Density:
|
0.9±0.1 g/cm3
|
|
Molecular_Structure:
|
['1 . Molar refractive index 2990 ', '2 . Molar volume 1218 ', '3 . Parachor （902K）2809 ', '4 . Surface tension 283 ', '5 . Polarizability 1185']
|
|
Computational_Chemistry:
|
['1. XlogP :04 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :13 ', '6. TPSA 341 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :105 ', '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']
|
|
FW:
|
114.142
|
|
LogP:
|
-0.27
|
|
Vapor_Pressure:
|
12.4±0.2 mmHg at 25°C
|
