Product_Name:	(1-Isocyanoethyl)benzene
Flash_Point:	N/A
Melting_Point:	N/A
FW:	131.17400
Density:	0.95
CAS:	17329-20-3
Bolling_Point:	98 °C (13.5018 mmHg)
MF:	C9H9N

Molecular_Structure:	['1 . Molar refractive index 4035 ', '2 . Molar volume （m3/mol）1328 ', '3 . Parachor （902K）3306 ', '4 表面张力（30 dyne/cm）383 ', '5 . Polarizability （05 10 -24cm 3）1599']
LogP:	1.89760
Refractive_Index:	1.507-1.51
FW:	131.17400
Density:	0.95
Bolling_Point:	98 °C (13.5018 mmHg)
Computational_Chemistry:	['1. XlogP :2 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 44 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :136 ', '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']
Water_Solubility:	不溶
MF:	C9H9N
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃） 095 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）无可用 ', '5 . Boiling point（ºC,Atmospheric pressure）98/135018 mmHg ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index1507-151 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility Insoluble in Water 。']
Exact_Mass:	131.07300