Chemical Properties of Glutaric acid, 3-methylbut-2-enyl pentyl ester

InChI

InChI=1S/C15H26O4/c1-4-5-6-11-18-14(16)8-7-9-15(17)19-12-10-13(2)3/h10H,4-9,11-12H2,1-3H3

InChI Key

KNPAAUCSSPQEBZ-UHFFFAOYSA-N

Formula

C15H26O4

SMILES

CCCCCOC(=O)CCCC(=O)OCC=C(C)C

Molecular Weight¹

270.36

• ω : Acentric Factor.
• 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).
• 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	0.7772		Relay (... Calculated Property
ΔfG°	-320.75	kJ/mol	Joback Calculated Property
ΔfH°gas	-880.54	kJ/mol	Relay (... Calculated Property
ΔfusH°	39.07	kJ/mol	Joback Calculated Property
ΔvapH°	79.00	kJ/mol	Relay (... Calculated Property
IE	8.60	eV	Relay (... Calculated Property
log10WS	-3.57		Relay (... Calculated Property
logPoct/wat	3.399		Crippen Calculated Property
McVol	232.790	ml/mol	McGowan Calculated Property
Pc	1588.54	kPa	Joback Calculated Property
Inp	[1904.00; 1904.00]
Inp	1904.00		NIST
Inp	1904.00		NIST
Tboil	577.77	K	Relay (... Calculated Property
Tc	736.28	K	Relay (... Calculated Property
Tfus	253.30	K	Relay (... Calculated Property
Vc	0.871	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[654.34; 737.48]	J/mol×K	[699.22; 881.91]
Cp,gas	654.34	J/mol×K	699.22	Joback Calculated Property
Cp,gas	670.11	J/mol×K	729.67	Joback Calculated Property
Cp,gas	685.10	J/mol×K	760.12	Joback Calculated Property
Cp,gas	699.32	J/mol×K	790.57	Joback Calculated Property
Cp,gas	712.77	J/mol×K	821.02	Joback Calculated Property
Cp,gas	725.49	J/mol×K	851.47	Joback Calculated Property
Cp,gas	737.48	J/mol×K	881.91	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3-methylbut-2-enyl pentyl ester.

Sources

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

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