Chemical Properties of Phthalic acid, decyl 4-methylpent-2-yl ester

InChI

InChI=1S/C24H38O4/c1-5-6-7-8-9-10-11-14-17-27-23(25)21-15-12-13-16-22(21)24(26)28-20(4)18-19(2)3/h12-13,15-16,19-20H,5-11,14,17-18H2,1-4H3

InChI Key

SRGWGBVAQOOHIP-UHFFFAOYSA-N

Formula

C24H38O4

SMILES

CCCCCCCCCCOC(=O)c1ccccc1C(=O)OC(C)CC(C)C

Molecular Weight¹

390.56

• 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	[491.95; 1153.24]	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			8.92000e+00
Coefficient B			2.04768e+00
Coefficient C			-1.06316e-03
Coefficient D			1.59800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	491.95	J/mol×K	273.00	Calculated Property
Cp,gas	607.36	J/mol×K	353.78	Calculated Property
Cp,gas	711.10	J/mol×K	434.56	Calculated Property
Cp,gas	803.69	J/mol×K	515.33	Calculated Property
Cp,gas	885.62	J/mol×K	596.11	Calculated Property
Cp,gas	957.41	J/mol×K	676.89	Calculated Property
Cp,gas	1019.57	J/mol×K	757.67	Calculated Property
Cp,gas	1072.58	J/mol×K	838.44	Calculated Property
Cp,gas	1116.97	J/mol×K	919.22	Calculated Property
Cp,gas	1153.24	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007974; 0.0000366]	Pa×s	[453.84; 769.87]	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			-1.46424e+01
Coefficient B			3.40752e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			453.84
Temperature range, max.			769.87
η	0.0007974	Pa×s	453.84	Calculated Property
η	0.0004650	Pa×s	488.95	Calculated Property
η	0.0002915	Pa×s	524.07	Calculated Property
η	0.0001938	Pa×s	559.18	Calculated Property
η	0.0001352	Pa×s	594.30	Calculated Property
η	0.0000982	Pa×s	629.41	Calculated Property
η	0.0000738	Pa×s	664.53	Calculated Property
η	0.0000570	Pa×s	699.64	Calculated Property
η	0.0000452	Pa×s	734.76	Calculated Property
η	0.0000366	Pa×s	769.87	Calculated Property

Similar Compounds

Find more compounds similar to Phthalic acid, decyl 4-methylpent-2-yl ester.

Sources

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

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