Chemical Properties of [2-(cyclohexylamino)-2-oxoethyl] benzoate

InChI

InChI=1S/C15H19NO3/c17-14(16-13-9-5-2-6-10-13)11-19-15(18)12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,16,17)

InChI Key

DQMPCJPRPFRUIT-UHFFFAOYSA-N

Formula

C15H19NO3

SMILES

O=C(COC(=O)c1ccccc1)NC1CCCCC1

Molecular Weight¹

261.32

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[615.59; 693.93]	J/mol×K	[769.16; 1003.18]
Cp,gas	615.59	J/mol×K	769.16	Joback Calculated Property
Cp,gas	632.02	J/mol×K	808.16	Joback Calculated Property
Cp,gas	647.03	J/mol×K	847.17	Joback Calculated Property
Cp,gas	660.68	J/mol×K	886.17	Joback Calculated Property
Cp,gas	673.01	J/mol×K	925.18	Joback Calculated Property
Cp,gas	684.08	J/mol×K	964.18	Joback Calculated Property
Cp,gas	693.93	J/mol×K	1003.18	Joback Calculated Property

Similar Compounds

Find more compounds similar to [2-(cyclohexylamino)-2-oxoethyl] benzoate.

Sources

• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method

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