Chemical Properties of Glutaric acid, di(non-5-yn-3-yl) ester

InChI

InChI=1S/C23H36O4/c1-5-9-11-13-16-20(7-3)26-22(24)18-15-19-23(25)27-21(8-4)17-14-12-10-6-2/h20-21H,5-10,15-19H2,1-4H3

InChI Key

RINRYEIEVQJOER-UHFFFAOYSA-N

Formula

C23H36O4

SMILES

CCCC#CCC(CC)OC(=O)CCCC(=O)OC(CC)CC#CCCC

Molecular Weight¹

376.53

• 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°	75.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-473.61	kJ/mol	Joback Calculated Property
ΔfusH°	60.10	kJ/mol	Joback Calculated Property
ΔvapH°	88.63	kJ/mol	Joback Calculated Property
log10WS	-6.99		Crippen Calculated Property
logPoct/wat	5.188		Crippen Calculated Property
McVol	332.610	ml/mol	McGowan Calculated Property
Pc	1112.59	kPa	Joback Calculated Property
Inp	[2542.00; 2542.00]
Inp	2542.00		NIST
Inp	2542.00		NIST
Tboil	895.34	K	Joback Calculated Property
Tc	1102.35	K	Joback Calculated Property
Tfus	675.49	K	Joback Calculated Property
Vc	1.284	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1050.74; 1136.85]	J/mol×K	[895.34; 1102.35]
Cp,gas	1050.74	J/mol×K	895.34	Joback Calculated Property
Cp,gas	1068.20	J/mol×K	929.84	Joback Calculated Property
Cp,gas	1084.38	J/mol×K	964.34	Joback Calculated Property
Cp,gas	1099.31	J/mol×K	998.85	Joback Calculated Property
Cp,gas	1113.02	J/mol×K	1033.35	Joback Calculated Property
Cp,gas	1125.52	J/mol×K	1067.85	Joback Calculated Property
Cp,gas	1136.85	J/mol×K	1102.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di(non-5-yn-3-yl) ester.

Sources

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

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