|
Refractive_Index:
|
1.674
|
|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
|
|
Flash_Point:
|
109.7±25.9 °C
|
|
LogP:
|
4.33
|
|
Bolling_Point:
|
286.8±0.0 °C at 760 mmHg
|
|
Water_Solubility:
|
71 mg/L (15 ºC)
|
|
PSA:
|
20.23000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 5120 ', '2 . Molar volume 1364 ', '3 . Parachor （902K）3737 ', '4 . Surface tension 563 ', '5 . Polarizability 2029']
|
|
Vapor_Density:
|
11.4 (vs air)
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 202 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :108 ', '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']
|
|
Melting_Point:
|
90-94 °C(lit.)
|
|
MF:
|
C6H3Br3O
|
|
Exact_Mass:
|
327.773376
|
|
FW:
|
330.799
|
|
Density:
|
2.4±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance White 粉末状晶体，味甜。 ', '2 . Density（g/mL,25℃）255 ', '3 . Relative vapor density（g/mL,Atmosphere =1）114 ', '4 . Melting point（ºC）90-94 ', '5 . Boiling point（ºC,Atmospheric pressure）244 ', '6 . Flash point（ºC）282-290 ', '7 . Solubility 易Soluble in 丙酮 Ethyl ether 苯甲基乙基酮甲苯 Ethanol 氯仿四氯化碳石油醚吡啶及苛性碱溶液，几乎Insoluble in Water 。']
|
