|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 3814 ', '2 . Molar volume 1302 ', '3 . Parachor （902K）3024 ', '4 . Surface tension 290 ', '5 . Polarizability 1512']
|
|
LogP:
|
2.46750
|
|
Flash_Point:
|
42ºC
|
|
Refractive_Index:
|
1.497
|
|
FW:
|
198.04500
|
|
Density:
|
1.53 g/cm3
|
|
Bolling_Point:
|
148ºC
|
|
Computational_Chemistry:
|
['1. XlogP :34 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :271 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
|
|
MF:
|
C5H11I
|
|
More_Info:
|
['一物性数据 ', '1 . Melting point（ºC）148ºC ', '2 . Density153g/mLat 25°C(lit ', '3 . Flash point（ºC）42ºC ', '4 . Boiling point（ºC）1435 ', '5相对. Density（20℃，4℃）15227 ', '6相对. Density（25℃，4℃）15138 ', '7 常温. Refractive index（n20）14977 ', '8 常温. Refractive index（n25）14950']
|
|
Exact_Mass:
|
197.99100
|
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