Product_Name:	1-isothiocyanato-3-methoxypropane
Flash_Point:	77 °C
Melting_Point:	N/A
FW:	131.19600
Density:	1.03
CAS:	17702-11-3
Bolling_Point:	102 °C (35 mmHg)
MF:	C5H9NOS

Molecular_Structure:	['1 . Molar refractive index 3716 ', '2 . Molar volume （m3/mol）1316 ', '3 . Parachor （902K）3075 ', '4 . Surface tension 297 ', '5 . Polarizability 1473']
Flash_Point:	77 °C
Refractive_Index:	1.501-1.503
FW:	131.19600
Density:	1.03
Bolling_Point:	102 °C (35 mmHg)
Computational_Chemistry:	['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 537 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :884 ', '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']
LogP:	1.12570
PSA:	53.68000
MF:	C5H9NOS
More_Info:	['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）103 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）不确定 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC,35mmHg）102 ', '7 . Refractive index1501-1503 ', '8 . Flash point（ºC）77 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定']
Vapor_Pressure:	0.538mmHg at 25°C
Exact_Mass:	131.04000