Chemical Properties of Cyclopropanamine, 1-benzyl-, sulfate (2 to 1)

InChI

InChI=1S/2C10H13N.H2O4S/c2*11-10(6-7-10)8-9-4-2-1-3-5-9;1-5(2,3)4/h2*1-5H,6-8,11H2;(H2,1,2,3,4)

InChI Key

IFHGHJXPICVILL-UHFFFAOYSA-N

Formula

C20H28N2O4S

SMILES

O=S(=O)([O-])[O-].[NH3+]C1(Cc2ccccc2)CC1.[NH3+]C1(Cc2ccccc2)CC1

Molecular Weight¹

392.51

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Cyclopropanamine, 1-benzyl-, sulfate (2 to 1).

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• NIST Webbook

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