Refractive_Index:
|
1.582
|
Vapor_Pressure:
|
0.0±0.8 mmHg at 25°C
|
Flash_Point:
|
170.6±28.4 °C
|
LogP:
|
2.29
|
Bolling_Point:
|
358.5±44.0 °C at 760 mmHg
|
PSA:
|
40.46000
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 4564 ', '2 . Molar volume (m3/mol)1367 ', '3 . Parachor (902K)3628 ', '4 . Surface tension 496 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 1809']
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 405 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :121 ', '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:
|
145-148
|
MF:
|
C7H8BBrO2
|
Exact_Mass:
|
213.980072
|
FW:
|
214.852
|
Density:
|
1.6±0.1 g/cm3
|
More_Info:
|
['1 . Appearance Solid ', '2 . Density(g/mL 25ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºCAtmospheric pressure)158-162 ', '5 . Boiling point(ºC,01mmHg)Unknow ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC,)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient (25℃)Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility (mg/mL) Unknow']
|