Chemical Properties of Glutaric acid, octyl phenethyl ester

InChI

InChI=1S/C21H32O4/c1-2-3-4-5-6-10-17-24-20(22)14-11-15-21(23)25-18-16-19-12-8-7-9-13-19/h7-9,12-13H,2-6,10-11,14-18H2,1H3

InChI Key

PWTIEHYLHIXQMQ-UHFFFAOYSA-N

Formula

C21H32O4

SMILES

CCCCCCCCOC(=O)CCCC(=O)OCCc1ccccc1

Molecular Weight¹

348.48

• 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	[426.39; 1000.43]	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			7.12000e-01
Coefficient B			1.81032e+00
Coefficient C			-9.60600e-04
Coefficient D			1.50000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	426.39	J/mol×K	273.00	Calculated Property
Cp,gas	527.58	J/mol×K	353.78	Calculated Property
Cp,gas	618.31	J/mol×K	434.56	Calculated Property
Cp,gas	699.05	J/mol×K	515.33	Calculated Property
Cp,gas	770.29	J/mol×K	596.11	Calculated Property
Cp,gas	832.49	J/mol×K	676.89	Calculated Property
Cp,gas	886.13	J/mol×K	757.67	Calculated Property
Cp,gas	931.69	J/mol×K	838.44	Calculated Property
Cp,gas	969.63	J/mol×K	919.22	Calculated Property
Cp,gas	1000.43	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010094; 0.0000655]	Pa×s	[437.51; 712.56]	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			-1.39854e+01
Coefficient B			3.10066e+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.			437.51
Temperature range, max.			712.56
η	0.0010094	Pa×s	437.51	Calculated Property
η	0.0006355	Pa×s	468.07	Calculated Property
η	0.0004234	Pa×s	498.63	Calculated Property
η	0.0002957	Pa×s	529.19	Calculated Property
η	0.0002147	Pa×s	559.76	Calculated Property
η	0.0001612	Pa×s	590.32	Calculated Property
η	0.0001245	Pa×s	620.88	Calculated Property
η	0.0000985	Pa×s	651.44	Calculated Property
η	0.0000796	Pa×s	682.00	Calculated Property
η	0.0000655	Pa×s	712.56	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, octyl phenethyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.