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

InChI

InChI=1S/C17H28O4/c1-13(2)11-12-20-16(18)9-6-10-17(19)21-14(3)15-7-4-5-8-15/h11,14-15H,4-10,12H2,1-3H3

InChI Key

HBXFNNBKRQXCHB-UHFFFAOYSA-N

Formula

C17H28O4

SMILES

CC(C)=CCOC(=O)CCCC(=O)OC(C)C1CCCC1

Molecular Weight¹

296.40

• 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°	-269.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-721.18	kJ/mol	Joback Calculated Property
ΔfusH°	34.66	kJ/mol	Joback Calculated Property
ΔvapH°	71.66	kJ/mol	Joback Calculated Property
log10WS	-4.28		Crippen Calculated Property
logPoct/wat	3.788		Crippen Calculated Property
McVol	250.110	ml/mol	McGowan Calculated Property
Pc	1583.49	kPa	Joback Calculated Property
Inp	[2029.00; 2029.00]
Inp	2029.00		NIST
Inp	2029.00		NIST
Tboil	759.82	K	Joback Calculated Property
Tc	961.03	K	Joback Calculated Property
Tfus	402.53	K	Joback Calculated Property
Vc	0.952	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[759.23; 850.83]	J/mol×K	[759.82; 961.03]
Cp,gas	759.23	J/mol×K	759.82	Joback Calculated Property
Cp,gas	777.18	J/mol×K	793.36	Joback Calculated Property
Cp,gas	794.01	J/mol×K	826.89	Joback Calculated Property
Cp,gas	809.75	J/mol×K	860.43	Joback Calculated Property
Cp,gas	824.45	J/mol×K	893.96	Joback Calculated Property
Cp,gas	838.13	J/mol×K	927.50	Joback Calculated Property
Cp,gas	850.83	J/mol×K	961.03	Joback Calculated Property

Similar Compounds

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

Sources

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

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