|
Refractive_Index:
|
1.46
|
|
Vapor_Pressure:
|
9.07E-05mmHg at 25°C
|
|
Flash_Point:
|
210 °F
|
|
LogP:
|
3.24220
|
|
Bolling_Point:
|
134ºC
|
|
PSA:
|
26.30000
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 5921 ', '2 . Molar volume 2169 ', '3 . Parachor （902K）5010 ', '4 . Surface tension 284 ', '5 . Polarizability 2347']
|
|
Computational_Chemistry:
|
['1. XlogP :35 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :233 ', '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 :1 ', '15. Covalently-Bonded Unit Count :1']
|
|
MF:
|
C12H20O2
|
|
Exact_Mass:
|
196.14600
|
|
FW:
|
196.28600
|
|
Density:
|
0.91
|
|
More_Info:
|
['一物性数据 ', '1Colourless to 微Yellow 油状Liquid ，有橙花and 玫瑰样香气。有蜂蜜and 覆盆子样风味。 ', '2. Density（g/mL , 20 ℃ ）0907 ', '3. Refractive index（nD20）14590 ', '4. Flash point（℃）98 ', '5. Boiling point（ºC）134 ', '6. Solubility 微Soluble in Water ，Soluble in Ethanol Ethyl ether and 常用有机溶剂以及精油。']
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