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Refractive_Index:
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1.653
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Flash_Point:
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228.2ºC
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|
LogP:
|
4.11300
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Bolling_Point:
|
453.7ºC at 760 mmHg
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PSA:
|
80.57000
|
|
Molecular_Structure:
|
['1. Molar refractive index 7217 ', '2. Molar volume 1971 ', '3. Parachor (902K)5515 ', '4. Surface tension 613 ', '5. Dielectric constant N/A ', '6. Polarizability 2861 ', '7. Single isotope mass 262077598Da ', '8. Nominal mass 262Da ', '9. Average mass 2623275Da']
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Computational_Chemistry:
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['1 . XlogP 21 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count ', '6 . TPSA 722 ', '7 . Heavy Atom Count 18 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 348 ', '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']
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Melting_Point:
|
183-185 °C(lit.)
|
|
MF:
|
C13H14N2O2S
|
|
Exact_Mass:
|
262.07800
|
|
FW:
|
262.32700
|
|
Density:
|
1.33g/cm3
|
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More_Info:
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['1 . Appearance Unknow ', '2 . Density(g/mLat 25°C)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)183-185 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,01mmHg)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(mmHg,37ºC)Unknow ', '12 . Saturated vapor pressure(kPa,1144 ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(MPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow']
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