Chemical Properties of Choline iodide, o-(o-nitrocinnamoyl)

InChI

InChI=1S/C14H19N2O4.HI/c1-16(2,3)10-11-20-14(17)9-8-12-6-4-5-7-13(12)15(18)19;/h4-9H,10-11H2,1-3H3;1H/q+1;/p-1/b9-8+;

InChI Key

VGIFSIONMLZOLJ-HRNDJLQDSA-M

Formula

C14H19IN2O4

SMILES

C[N+](C)(C)CCOC(=O)C=Cc1ccccc1[N+](=O)[O-].[I-]

Molecular Weight¹

406.22

• IE : Ionization energy (eV).
• 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 formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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 Choline iodide, o-(o-nitrocinnamoyl).

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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