Chemical Properties of Succinic acid, heptyl 4-phenoxybenzyl ester

InChI

InChI=1S/C24H30O5/c1-2-3-4-5-9-18-27-23(25)16-17-24(26)28-19-20-12-14-22(15-13-20)29-21-10-7-6-8-11-21/h6-8,10-15H,2-5,9,16-19H2,1H3

InChI Key

UTVMUXNJZHFZSX-UHFFFAOYSA-N

Formula

C24H30O5

SMILES

CCCCCCCOC(=O)CCC(=O)OCc1ccc(Oc2ccccc2)cc1

Molecular Weight¹

398.50

• ω : Acentric Factor.
• 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).
• 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

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[450.73; 1052.14]	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			3.87900e+00
Coefficient B			1.89372e+00
Coefficient C			-9.76960e-04
Coefficient D			1.31500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	450.73	J/mol×K	273.00	Calculated Property
Cp,gas	557.38	J/mol×K	353.78	Calculated Property
Cp,gas	653.11	J/mol×K	434.56	Calculated Property
Cp,gas	738.32	J/mol×K	515.33	Calculated Property
Cp,gas	813.44	J/mol×K	596.11	Calculated Property
Cp,gas	878.88	J/mol×K	676.89	Calculated Property
Cp,gas	935.05	J/mol×K	757.67	Calculated Property
Cp,gas	982.37	J/mol×K	838.44	Calculated Property
Cp,gas	1021.27	J/mol×K	919.22	Calculated Property
Cp,gas	1052.14	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003112; 0.0000321]	Pa×s	[532.49; 815.35]	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			-1.46243e+01
Coefficient B			3.48739e+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.			532.49
Temperature range, max.			815.35
η	0.0003112	Pa×s	532.49	Calculated Property
η	0.0002160	Pa×s	563.92	Calculated Property
η	0.0001559	Pa×s	595.35	Calculated Property
η	0.0001162	Pa×s	626.78	Calculated Property
η	0.0000891	Pa×s	658.20	Calculated Property
η	0.0000700	Pa×s	689.63	Calculated Property
η	0.0000561	Pa×s	721.06	Calculated Property
η	0.0000459	Pa×s	752.49	Calculated Property
η	0.0000381	Pa×s	783.92	Calculated Property
η	0.0000321	Pa×s	815.35	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, heptyl 4-phenoxybenzyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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