Chemical Properties of Glutaric acid, 3-methylbut-2-yl 4-biphenyl ester

InChI

InChI=1S/C22H26O4/c1-16(2)17(3)25-21(23)10-7-11-22(24)26-20-14-12-19(13-15-20)18-8-5-4-6-9-18/h4-6,8-9,12-17H,7,10-11H2,1-3H3

InChI Key

JMRHEGMYRWXYPU-UHFFFAOYSA-N

Formula

C22H26O4

SMILES

CC(C)C(C)OC(=O)CCCC(=O)Oc1ccc(-c2ccccc2)cc1

Molecular Weight¹

354.44

• 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

Property	Value	Unit	Source
ω	0.8701		Relay (1.0) Calculated Property
ΔfG°	-123.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-672.85	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	38.96	kJ/mol	Joback Calculated Property
ΔvapH°	109.68	kJ/mol	Relay (1.0) Calculated Property
IE	8.17	eV	Relay (1.0) Calculated Property
log10WS	-5.00		Relay (1.0) Calculated Property
logPoct/wat	5.017		Crippen Calculated Property
McVol	288.200	ml/mol	McGowan Calculated Property
Pc	1508.15	kPa	Joback Calculated Property
Inp	[2760.00; 2760.00]
Inp	2760.00		NIST
Inp	2760.00		NIST
Tboil	682.59	K	Relay (1.0) Calculated Property
Tc	910.31	K	Relay (1.0) Calculated Property
Tfus	370.16	K	Relay (1.0) Calculated Property
Vc	1.038	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[898.83; 966.05]	J/mol×K	[912.80; 1139.10]
Cp,gas	898.83	J/mol×K	912.80	Joback Calculated Property
Cp,gas	913.38	J/mol×K	950.52	Joback Calculated Property
Cp,gas	926.53	J/mol×K	988.23	Joback Calculated Property
Cp,gas	938.32	J/mol×K	1025.95	Joback Calculated Property
Cp,gas	948.81	J/mol×K	1063.67	Joback Calculated Property
Cp,gas	958.04	J/mol×K	1101.39	Joback Calculated Property
Cp,gas	966.05	J/mol×K	1139.10	Joback Calculated Property
η	[0.0000354; 0.0005200]	Pa×s	[517.38; 912.80]
η	0.0005200	Pa×s	517.38	Joback Calculated Property
η	0.0002580	Pa×s	583.28	Joback Calculated Property
η	0.0001476	Pa×s	649.19	Joback Calculated Property
η	0.0000936	Pa×s	715.09	Joback Calculated Property
η	0.0000641	Pa×s	780.99	Joback Calculated Property
η	0.0000465	Pa×s	846.90	Joback Calculated Property
η	0.0000354	Pa×s	912.80	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3-methylbut-2-yl 4-biphenyl ester.

Sources

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

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