Chemical Properties of Phthalic acid, pent-4-enyl tetradecyl ester

InChI

InChI=1S/C27H42O4/c1-3-5-7-8-9-10-11-12-13-14-15-19-23-31-27(29)25-21-17-16-20-24(25)26(28)30-22-18-6-4-2/h4,16-17,20-21H,2-3,5-15,18-19,22-23H2,1H3

InChI Key

SRJGONFEMGGXPQ-UHFFFAOYSA-N

Formula

C27H42O4

SMILES

C=CCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCCC

Molecular Weight¹

430.63

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[546.41; 1278.43]	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			6.56600e+00
Coefficient B			2.30082e+00
Coefficient C			-1.24286e-03
Coefficient D			2.13900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	546.41	J/mol×K	273.00	Calculated Property
Cp,gas	674.46	J/mol×K	353.78	Calculated Property
Cp,gas	789.25	J/mol×K	434.56	Calculated Property
Cp,gas	891.46	J/mol×K	515.33	Calculated Property
Cp,gas	981.77	J/mol×K	596.11	Calculated Property
Cp,gas	1060.85	J/mol×K	676.89	Calculated Property
Cp,gas	1129.38	J/mol×K	757.67	Calculated Property
Cp,gas	1188.04	J/mol×K	838.44	Calculated Property
Cp,gas	1237.49	J/mol×K	919.22	Calculated Property
Cp,gas	1278.43	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003870; 0.0000294]	Pa×s	[515.89; 824.80]	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			-1.47368e+01
Coefficient B			3.54920e+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.			515.89
Temperature range, max.			824.80
η	0.0003870	Pa×s	515.89	Calculated Property
η	0.0002520	Pa×s	550.21	Calculated Property
η	0.0001725	Pa×s	584.54	Calculated Property
η	0.0001232	Pa×s	618.86	Calculated Property
η	0.0000911	Pa×s	653.18	Calculated Property
η	0.0000695	Pa×s	687.51	Calculated Property
η	0.0000544	Pa×s	721.83	Calculated Property
η	0.0000435	Pa×s	756.16	Calculated Property
η	0.0000355	Pa×s	790.48	Calculated Property
η	0.0000294	Pa×s	824.80	Calculated Property

Similar Compounds

Find more compounds similar to Phthalic acid, pent-4-enyl tetradecyl ester.

Sources

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

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