Chemical Properties of Glutaric acid, oct-1-en-3-yl dodec-2-en-1-yl ester

InChI

InChI=1S/C25H44O4/c1-4-7-9-10-11-12-13-14-15-17-22-28-24(26)20-18-21-25(27)29-23(6-3)19-16-8-5-2/h6,15,17,23H,3-5,7-14,16,18-22H2,1-2H3/b17-15+

InChI Key

HPQXRJVNRNVUPY-BMRADRMJSA-N

Formula

C25H44O4

SMILES

C=CC(CCCCC)OC(=O)CCCC(=O)OCC=CCCCCCCCCC

Molecular Weight¹

408.61

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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°	-142.60	kJ/mol	Joback Calculated Property
ΔfH°gas	-811.56	kJ/mol	Joback Calculated Property
ΔfusH°	61.48	kJ/mol	Joback Calculated Property
ΔvapH°	88.46	kJ/mol	Joback Calculated Property
log10WS	-7.83		Crippen Calculated Property
logPoct/wat	7.075		Crippen Calculated Property
McVol	369.390	ml/mol	McGowan Calculated Property
Pc	852.97	kPa	Joback Calculated Property
Inp	[2713.00; 2713.00]
Inp	2713.00		NIST
Inp	2713.00		NIST
Tboil	924.38	K	Joback Calculated Property
Tc	1132.51	K	Joback Calculated Property
Tfus	493.99	K	Joback Calculated Property
Vc	1.438	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1224.89; 1322.96]	J/mol×K	[924.38; 1132.51]
Cp,gas	1224.89	J/mol×K	924.38	Joback Calculated Property
Cp,gas	1244.33	J/mol×K	959.07	Joback Calculated Property
Cp,gas	1262.46	J/mol×K	993.76	Joback Calculated Property
Cp,gas	1279.33	J/mol×K	1028.44	Joback Calculated Property
Cp,gas	1295.00	J/mol×K	1063.13	Joback Calculated Property
Cp,gas	1309.52	J/mol×K	1097.82	Joback Calculated Property
Cp,gas	1322.96	J/mol×K	1132.51	Joback Calculated Property
η	[0.0000217; 0.0005106]	Pa×s	[493.99; 924.38]
η	0.0005106	Pa×s	493.99	Joback Calculated Property
η	0.0002161	Pa×s	565.72	Joback Calculated Property
η	0.0001110	Pa×s	637.45	Joback Calculated Property
η	0.0000652	Pa×s	709.18	Joback Calculated Property
η	0.0000423	Pa×s	780.92	Joback Calculated Property
η	0.0000295	Pa×s	852.65	Joback Calculated Property
η	0.0000217	Pa×s	924.38	Joback Calculated Property

Similar Compounds

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

Sources

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

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