Chemical Properties of [2-(acetyl-methylamino)-2-oxoethyl] benzoate

InChI

InChI=1S/C12H13NO4/c1-9(14)13(2)11(15)8-17-12(16)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3

InChI Key

JQUIGGQYRQVIIE-UHFFFAOYSA-N

Formula

C12H13NO4

SMILES

CC(=O)N(C)C(=O)COC(=O)c1ccccc1

Molecular Weight¹

235.24

• 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	[464.89; 526.96]	J/mol×K	[697.11; 913.89]
Cp,gas	464.89	J/mol×K	697.11	Joback Calculated Property
Cp,gas	477.47	J/mol×K	733.24	Joback Calculated Property
Cp,gas	489.11	J/mol×K	769.37	Joback Calculated Property
Cp,gas	499.84	J/mol×K	805.50	Joback Calculated Property
Cp,gas	509.71	J/mol×K	841.63	Joback Calculated Property
Cp,gas	518.74	J/mol×K	877.76	Joback Calculated Property
Cp,gas	526.96	J/mol×K	913.89	Joback Calculated Property

Similar Compounds

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

Sources

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

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