Aminomalononitrile p-Toluenesulfonate

1. Reference value for calculating hydrophobic parameters (XlogP) : None
2. Number of hydrogen bond donors :2
3. Number of hydrogen bond receptors :6
4. Number of rotatable chemical bonds :1
5. Number of tautomers: None
6. Topological molecular polar surface area 136
7. Number of heavy atoms :17
8. Surface charge :0
9. Complexity :310
10. Number of isotope atoms :0
11. Determine the number of protonic centers :0
12. Number of uncertain atomic stereocentes :0
13. Determine the number of chemical bond structure centers :0
14. Number of uncertain chemical bond stereocenter :0
15. Number of covalent bond units :2
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1. Properties: White powder
2. Density (g/mL,25/4 ° C) : uncertain
3. Relative vapor density (g/mL, air =1) : uncertain
4. Melting point (℃) : 174
5. Boiling point (℃, atmospheric pressure) : uncertain
6. Boiling point (° C, 5 mmHg) : uncertain
7. Refractive index (nD20) : uncertain
8. Flash point (° F) : Uncertain
9. Specific rotation (º, C=1, water) : uncertain
10. Spontaneous ignition point or ignition temperature (° C) : uncertain
11. Vapor pressure (kPa,25 ° C) : uncertain
12. Saturated vapor pressure (kPa,60 ° C) : uncertain
13. Heat of combustion (KJ/mol) : uncertain
14. Critical temperature (° C) : uncertain
15. Critical pressure (KPa) : Uncertain