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

InChI

InChI=1S/C17H30O4/c1-12(2)10-11-20-15(18)8-7-9-16(19)21-17(13(3)4)14(5)6/h10,13-14,17H,7-9,11H2,1-6H3

InChI Key

VUHSGQPPQFIUPZ-UHFFFAOYSA-N

Formula

C17H30O4

SMILES

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

Molecular Weight¹

298.42

• 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°	-311.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-792.22	kJ/mol	Joback Calculated Property
ΔfusH°	33.68	kJ/mol	Joback Calculated Property
ΔvapH°	70.62	kJ/mol	Joback Calculated Property
log10WS	-4.15		Crippen Calculated Property
logPoct/wat	3.890		Crippen Calculated Property
McVol	260.970	ml/mol	McGowan Calculated Property
Pc	1395.41	kPa	Joback Calculated Property
Inp	[1886.00; 1886.00]
Inp	1886.00		NIST
Inp	1886.00		NIST
Tboil	743.66	K	Joback Calculated Property
Tc	932.47	K	Joback Calculated Property
Tfus	361.63	K	Joback Calculated Property
Vc	0.999	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[768.43; 857.82]	J/mol×K	[743.66; 932.47]
Cp,gas	768.43	J/mol×K	743.66	Joback Calculated Property
Cp,gas	785.63	J/mol×K	775.13	Joback Calculated Property
Cp,gas	801.88	J/mol×K	806.60	Joback Calculated Property
Cp,gas	817.21	J/mol×K	838.07	Joback Calculated Property
Cp,gas	831.62	J/mol×K	869.54	Joback Calculated Property
Cp,gas	845.15	J/mol×K	901.00	Joback Calculated Property
Cp,gas	857.82	J/mol×K	932.47	Joback Calculated Property

Similar Compounds

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

Sources

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

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