Chemical Properties of 2-Ethylhexyl 2-phenoxybenzoate

InChI

InChI=1S/C21H26O3/c1-3-5-11-17(4-2)16-23-21(22)19-14-9-10-15-20(19)24-18-12-7-6-8-13-18/h6-10,12-15,17H,3-5,11,16H2,1-2H3

InChI Key

MFXGMWHXGXQNKD-UHFFFAOYSA-N

Formula

C21H26O3

SMILES

CCCCC(CC)COC(=O)c1ccccc1Oc1ccccc1

Molecular Weight¹

326.43

• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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	[370.44; 889.80]	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			-2.04850e+01
Coefficient B			1.66944e+00
Coefficient C			-9.11560e-04
Coefficient D			1.52400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	370.44	J/mol×K	273.00	Calculated Property
Cp,gas	462.78	J/mol×K	353.78	Calculated Property
Cp,gas	545.35	J/mol×K	434.56	Calculated Property
Cp,gas	618.61	J/mol×K	515.33	Calculated Property
Cp,gas	683.05	J/mol×K	596.11	Calculated Property
Cp,gas	739.15	J/mol×K	676.89	Calculated Property
Cp,gas	787.39	J/mol×K	757.67	Calculated Property
Cp,gas	828.26	J/mol×K	838.44	Calculated Property
Cp,gas	862.23	J/mol×K	919.22	Calculated Property
Cp,gas	889.80	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008011; 0.0000640]	Pa×s	[441.35; 724.78]	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			-1.35938e+01
Coefficient B			2.85301e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			441.35
Temperature range, max.			724.78
η	0.0008011	Pa×s	441.35	Calculated Property
η	0.0005209	Pa×s	472.84	Calculated Property
η	0.0003573	Pa×s	504.34	Calculated Property
η	0.0002563	Pa×s	535.83	Calculated Property
η	0.0001907	Pa×s	567.32	Calculated Property
η	0.0001464	Pa×s	598.81	Calculated Property
η	0.0001154	Pa×s	630.31	Calculated Property
η	0.0000930	Pa×s	661.80	Calculated Property
η	0.0000765	Pa×s	693.29	Calculated Property
η	0.0000640	Pa×s	724.78	Calculated Property

Similar Compounds

Find more compounds similar to 2-Ethylhexyl 2-phenoxybenzoate.

Sources

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

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