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

InChI

InChI=1S/C15H18O4/c1-3-5-8-11-19-15(17)13-10-7-6-9-12(13)14(16)18-4-2/h3,6-7,9-10H,1,4-5,8,11H2,2H3

InChI Key

BLAVCVRCTOSDLW-UHFFFAOYSA-N

Formula

C15H18O4

SMILES

C=CCCCOC(=O)c1ccccc1C(=O)OCC

Molecular Weight¹

262.30

• 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	[291.85; 659.33]	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			1.74740e+01
Coefficient B			1.16082e+00
Coefficient C			-5.90060e-04
Coefficient D			7.11000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	291.85	J/mol×K	273.00	Calculated Property
Cp,gas	357.44	J/mol×K	353.78	Calculated Property
Cp,gas	416.32	J/mol×K	434.56	Calculated Property
Cp,gas	468.71	J/mol×K	515.33	Calculated Property
Cp,gas	514.84	J/mol×K	596.11	Calculated Property
Cp,gas	554.92	J/mol×K	676.89	Calculated Property
Cp,gas	589.18	J/mol×K	757.67	Calculated Property
Cp,gas	617.86	J/mol×K	838.44	Calculated Property
Cp,gas	641.17	J/mol×K	919.22	Calculated Property
Cp,gas	659.33	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015203; 0.0001281]	Pa×s	[380.65; 623.22]	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			-1.28445e+01
Coefficient B			2.41928e+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.			380.65
Temperature range, max.			623.22
η	0.0015203	Pa×s	380.65	Calculated Property
η	0.0009987	Pa×s	407.60	Calculated Property
η	0.0006911	Pa×s	434.56	Calculated Property
η	0.0004993	Pa×s	461.51	Calculated Property
η	0.0003739	Pa×s	488.46	Calculated Property
η	0.0002886	Pa×s	515.41	Calculated Property
η	0.0002285	Pa×s	542.37	Calculated Property
η	0.0001850	Pa×s	569.32	Calculated Property
η	0.0001527	Pa×s	596.27	Calculated Property
η	0.0001281	Pa×s	623.22	Calculated Property

Similar Compounds

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

Sources

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

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