|
MF:
|
C7H6ClNO2
|
|
Water_Solubility:
|
49 mg/L (20 ºC)
|
|
Bolling_Point:
|
256.8±20.0 °C at 760 mmHg
|
|
Exact_Mass:
|
171.008713
|
|
More_Info:
|
['1 . Appearance 针状结晶。 ', '2 . Refractive index（nD20）15470 ', '3 . Melting point（℃）68℃ ', '4 . Boiling point（ºC,20kpa）260℃ ', ' 5 . Solubility Soluble in Ethyl ether Ethanol and 乙酸，微Soluble in 热Water 。能随Water 蒸气一同挥发。']
|
|
Melting_Point:
|
61 °C
|
|
PSA:
|
45.82000
|
|
Flash_Point:
|
109.1±21.8 °C
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 458 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :157 ', '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']
|
|
Density:
|
1.3±0.1 g/cm3
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 4251 ', '2 . Molar volume （m3/mol）1295 ', '3 . Parachor （902K）3362 ', '4 . Surface tension 454 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 1685']
|
|
Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
|
|
FW:
|
171.581
|
|
LogP:
|
3.10
|
|
Refractive_Index:
|
1.570
|
