| Exact_Mass: | 164.040817 | 
                                                    
                                                        
                                                            | Computational_Chemistry: | ['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 672 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :151 ', '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'] | 
                                                    
                                                        
                                                            | Bolling_Point: | 322.0±35.0 °C at 760 mmHg | 
                                                    
                                                        
                                                            | Flash_Point: | 148.6±25.9 °C | 
                                                    
                                                        
                                                            | More_Info: | ['1 . Appearance White 疏松状结晶体。   ', '2 . Density(g/mL,25/4℃) Unknow  ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow  ', '4 . Melting point(ºC)137-139 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow  ', '6 . Boiling point(ºC,52kPa) Unknow  ', '7 . Refractive index Unknow  ', '8 . Flash point(ºC) Unknow  ', '9 . Specific rotation(º) Unknow  ', '10 . Spontaneous ignition point or ignition temperature(ºC) Unknow  ', '11 . Vapor pressure(kPa,25ºC) Unknow  ', '12 . Saturated vapor pressure(kPa,60ºC) Unknow  ', '13 . Combustion heat(KJ/mol)Unknow  ', '14 . Critical temperature(ºC) Unknow  ', '15 . Critical pressure(KPa) 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 Insoluble in Water 。'] | 
                                                    
                                                        
                                                            | Molecular_Structure: | ['1 . Molar refractive index 5022   ', '2 . Molar volume (m3/mol)1388  ', '3 . Parachor (902K)3637  ', '4 . Surface tension : 471  ', '5 . Dielectric constant 无可用  ', '6 偶极距(10   -24cm 3)无可用  ', '7 . Polarizability 1990'] | 
                                                    
                                                        
                                                            | Vapor_Pressure: | 0.0±0.7 mmHg at 25°C | 
                                                    
                                                        
                                                            | PSA: | 67.15000 | 
                                                    
                                                        
                                                            | Density: | 1.3±0.1 g/cm3 | 
                                                    
                                                        
                                                            | FW: | 164.227 | 
                                                    
                                                        
                                                            | MF: | C8H8N2S | 
                                                    
                                                        
                                                            | Refractive_Index: | 1.726 | 
                                                    
                                                        
                                                            | LogP: | 2.35 | 
                                                    
                                                        
                                                            | Melting_Point: | 137-139 °C(lit.) |