Chemical Properties of Noxiptyline M(Nor-HO), acetylated

InChI

InChI=1S/C22H24N2O4/c1-15(25)24(3)12-13-27-23-22-20-7-5-4-6-17(20)8-9-18-14-19(28-16(2)26)10-11-21(18)22/h4-7,10-11,14H,8-9,12-13H2,1-3H3

InChI Key

UBNVSMLTEYHCIB-UHFFFAOYSA-N

Formula

C22H24N2O4

SMILES

CC(=O)Oc1ccc2c(c1)CCc1ccccc1C2=NOCCN(C)C(C)=O

Molecular Weight¹

380.44

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Similar Compounds

Find more compounds similar to Noxiptyline M(Nor-HO), acetylated.

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.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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