Chemical Properties of Glutaric acid, 1-phenylpropyl tetradecyl ester

InChI

InChI=1S/C28H46O4/c1-3-5-6-7-8-9-10-11-12-13-14-18-24-31-27(29)22-19-23-28(30)32-26(4-2)25-20-16-15-17-21-25/h15-17,20-21,26H,3-14,18-19,22-24H2,1-2H3

InChI Key

SOVLZKTXBHEFSA-UHFFFAOYSA-N

Formula

C28H46O4

SMILES

CCCCCCCCCCCCCCOC(=O)CCCC(=O)OC(CC)c1ccccc1

Molecular Weight¹

446.66

• 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).
• 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, Ionization energy 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	[574.57; 1362.11]	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			-7.33300e+00
Coefficient B			2.48124e+00
Coefficient C			-1.34460e-03
Coefficient D			2.32800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	574.57	J/mol×K	273.00	Calculated Property
Cp,gas	712.49	J/mol×K	353.78	Calculated Property
Cp,gas	836.10	J/mol×K	434.56	Calculated Property
Cp,gas	946.11	J/mol×K	515.33	Calculated Property
Cp,gas	1043.27	J/mol×K	596.11	Calculated Property
Cp,gas	1128.32	J/mol×K	676.89	Calculated Property
Cp,gas	1202.00	J/mol×K	757.67	Calculated Property
Cp,gas	1265.03	J/mol×K	838.44	Calculated Property
Cp,gas	1318.15	J/mol×K	919.22	Calculated Property
Cp,gas	1362.11	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0004573; 0.0000212]	Pa×s	[501.40; 843.62]	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			-1.52642e+01
Coefficient B			3.79760e+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.			501.40
Temperature range, max.			843.62
η	0.0004573	Pa×s	501.40	Calculated Property
η	0.0002681	Pa×s	539.42	Calculated Property
η	0.0001687	Pa×s	577.45	Calculated Property
η	0.0001123	Pa×s	615.47	Calculated Property
η	0.0000785	Pa×s	653.50	Calculated Property
η	0.0000570	Pa×s	691.52	Calculated Property
η	0.0000428	Pa×s	729.54	Calculated Property
η	0.0000331	Pa×s	767.57	Calculated Property
η	0.0000262	Pa×s	805.59	Calculated Property
η	0.0000212	Pa×s	843.62	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 1-phenylpropyl tetradecyl ester.

Sources

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

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