(S)-Propane-1,2-diamine sulfate (136370-46-2)

The (S)-Propane-1,2-diamine sulfate is an organic compound with the formula C₃H₁₀N₂^.H₂SO₄. The systematic name of this chemical is (2S)-propane-1,2-diamine sulfate. With the CAS registry number 136370-46-2, it is also named as 1,2-propanediamine, (2S)-, sulfate (1:1).

Physical properties about (S)-Propane-1,2-diamine sulfate are: (1)# of Rule of 5 Violations: 1; (2)#H bond acceptors: 6; (3)#H bond donors: 6; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 135.02 Å²; (6)Flash Point: 189 °C; (7)Enthalpy of Vaporization: 70.06 kJ/mol; (8)Boiling Point: 388.9 °C at 760 mmHg; (9)Vapour Pressure: 3.93E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)(1)SMILES: N[C@@H](C)CN.OS(O)(=O)=O
(2)InChI: InChI=1/C3H10N2.H2O4S/c1-3(5)2-4;1-5(2,3)4/h3H,2,4-5H2,1H3;(H2,1,2,3,4)/t3-;/m0./s1
(3)InChIKey: VFDQRKYOFLFZPW-DFWYDOINBV
(4)Std. InChI: InChI=1S/C3H10N2.H2O4S/c1-3(5)2-4;1-5(2,3)4/h3H,2,4-5H2,1H3;(H2,1,2,3,4)/t3-;/m0./s1
(5)Std. InChIKey: VFDQRKYOFLFZPW-DFWYDOINSA-N