Chemical Properties of Glutaric acid, 2-ethylhexyl 2-methoxyphenyl ester

InChI

InChI=1S/C20H30O5/c1-4-6-10-16(5-2)15-24-19(21)13-9-14-20(22)25-18-12-8-7-11-17(18)23-3/h7-8,11-12,16H,4-6,9-10,13-15H2,1-3H3

InChI Key

GBONECMRGSKJHW-UHFFFAOYSA-N

Formula

C20H30O5

SMILES

CCCCC(CC)COC(=O)CCCC(=O)Oc1ccccc1OC

Molecular Weight¹

350.45

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion 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

Property	Value	Unit	Source
ΔfusH°	47.61	kJ/mol	Joback Calculated Property
log10WS	-4.48		Relay (1.0) Calculated Property
logPoct/wat	4.530		Crippen Calculated Property
McVol	289.650	ml/mol	McGowan Calculated Property
Pc	1256.59	kPa	Joback Calculated Property
Inp	[2469.00; 2469.00]
Inp	2469.00		NIST
Inp	2469.00		NIST
Tboil	647.47	K	Relay (1.0) Calculated Property
Tfus	278.50	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[422.82; 964.84]	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			3.97380e+01
Coefficient B			1.59856e+00
Coefficient C			-7.31360e-04
Coefficient D			5.79000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	422.82	J/mol×K	273.00	Calculated Property
Cp,gas	516.30	J/mol×K	353.78	Calculated Property
Cp,gas	601.04	J/mol×K	434.56	Calculated Property
Cp,gas	677.23	J/mol×K	515.33	Calculated Property
Cp,gas	745.03	J/mol×K	596.11	Calculated Property
Cp,gas	804.65	J/mol×K	676.89	Calculated Property
Cp,gas	856.25	J/mol×K	757.67	Calculated Property
Cp,gas	900.03	J/mol×K	838.44	Calculated Property
Cp,gas	936.16	J/mol×K	919.22	Calculated Property
Cp,gas	964.84	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007304; 0.0000520]	Pa×s	[445.99; 717.45]	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			-1.42068e+01
Coefficient B			3.11515e+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.			445.99
Temperature range, max.			717.45
η	0.0007304	Pa×s	445.99	Calculated Property
η	0.0004692	Pa×s	476.15	Calculated Property
η	0.0003178	Pa×s	506.31	Calculated Property
η	0.0002249	Pa×s	536.48	Calculated Property
η	0.0001651	Pa×s	566.64	Calculated Property
η	0.0001250	Pa×s	596.80	Calculated Property
η	0.0000973	Pa×s	626.96	Calculated Property
η	0.0000774	Pa×s	657.12	Calculated Property
η	0.0000629	Pa×s	687.28	Calculated Property
η	0.0000520	Pa×s	717.45	Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-ethylhexyl 2-methoxyphenyl ester.

Sources

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

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