Chemical Properties of Succinic acid, 3-methylbutyl 2-naphthylmethyl ester

InChI

InChI=1S/C20H24O4/c1-15(2)11-12-23-19(21)9-10-20(22)24-14-16-7-8-17-5-3-4-6-18(17)13-16/h3-8,13,15H,9-12,14H2,1-2H3

InChI Key

JOTYNWSVEOMTKG-UHFFFAOYSA-N

Formula

C20H24O4

SMILES

CC(C)CCOC(=O)CCC(=O)OCc1ccc2ccccc2c1

Molecular Weight¹

328.40

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[366.41; 855.55]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.72050e+01
Coefficient B			1.65804e+00
Coefficient C			-9.79080e-04
Coefficient D			1.93800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	366.41	J/mol×K	273.00	Calculated Property
Cp,gas	455.41	J/mol×K	353.78	Calculated Property
Cp,gas	534.32	J/mol×K	434.56	Calculated Property
Cp,gas	603.75	J/mol×K	515.33	Calculated Property
Cp,gas	664.31	J/mol×K	596.11	Calculated Property
Cp,gas	716.61	J/mol×K	676.89	Calculated Property
Cp,gas	761.28	J/mol×K	757.67	Calculated Property
Cp,gas	798.92	J/mol×K	838.44	Calculated Property
Cp,gas	830.14	J/mol×K	919.22	Calculated Property
Cp,gas	855.56	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010505; 0.0001178]	Pa×s	[456.46; 725.19]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.27637e+01
Coefficient B			2.69550e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			456.46
Temperature range, max.			725.19
η	0.0010505	Pa×s	456.46	Calculated Property
η	0.0007310	Pa×s	486.32	Calculated Property
η	0.0005305	Pa×s	516.18	Calculated Property
η	0.0003987	Pa×s	546.04	Calculated Property
η	0.0003087	Pa×s	575.89	Calculated Property
η	0.0002451	Pa×s	605.75	Calculated Property
η	0.0001989	Pa×s	635.61	Calculated Property
η	0.0001644	Pa×s	665.47	Calculated Property
η	0.0001382	Pa×s	695.33	Calculated Property
η	0.0001178	Pa×s	725.19	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-methylbutyl 2-naphthylmethyl ester.

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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