Chemical Properties of Glutaric acid, 3-methylbut-2-en-1-yl 4-biphenyl ester

InChI

InChI=1S/C22H24O4/c1-17(2)15-16-25-21(23)9-6-10-22(24)26-20-13-11-19(12-14-20)18-7-4-3-5-8-18/h3-5,7-8,11-15H,6,9-10,16H2,1-2H3

InChI Key

LSKPNBMIYXPFKC-UHFFFAOYSA-N

Formula

C22H24O4

SMILES

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

Molecular Weight¹

352.42

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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
ΔfG°	-46.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-417.99	kJ/mol	Joback Calculated Property
ΔfusH°	44.90	kJ/mol	Joback Calculated Property
ΔvapH°	88.13	kJ/mol	Joback Calculated Property
log10WS	-6.45		Crippen Calculated Property
logPoct/wat	4.939		Crippen Calculated Property
McVol	283.900	ml/mol	McGowan Calculated Property
Pc	1557.35	kPa	Joback Calculated Property
Inp	[2860.00; 2860.00]
Inp	2860.00		NIST
Inp	2860.00		NIST
Tboil	917.72	K	Joback Calculated Property
Tc	1146.47	K	Joback Calculated Property
Tfus	528.34	K	Joback Calculated Property
Vc	1.081	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[869.39; 937.12]	J/mol×K	[917.72; 1146.47]
Cp,gas	869.39	J/mol×K	917.72	Joback Calculated Property
Cp,gas	883.56	J/mol×K	955.85	Joback Calculated Property
Cp,gas	896.49	J/mol×K	993.97	Joback Calculated Property
Cp,gas	908.24	J/mol×K	1032.10	Joback Calculated Property
Cp,gas	918.89	J/mol×K	1070.22	Joback Calculated Property
Cp,gas	928.49	J/mol×K	1108.35	Joback Calculated Property
Cp,gas	937.12	J/mol×K	1146.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3-methylbut-2-en-1-yl 4-biphenyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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