Chemical Properties of Glutaric acid, 3-methylbutyl pentadecyl ester

InChI

InChI=1S/C25H48O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-21-28-24(26)18-17-19-25(27)29-22-20-23(2)3/h23H,4-22H2,1-3H3

InChI Key

ZSKUAQRTGPRHBR-UHFFFAOYSA-N

Formula

C25H48O4

SMILES

CCCCCCCCCCCCCCCOC(=O)CCCC(=O)OCCC(C)C

Molecular Weight¹

412.65

• ω : Acentric Factor.
• 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).
• 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	1.1849		Relay (1.0) Calculated Property
ΔfG°	-463.56	kJ/mol	Joback Calculated Property
ΔfH°gas	-1178.25	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	65.72	kJ/mol	Joback Calculated Property
ΔvapH°	116.88	kJ/mol	Relay (1.0) Calculated Property
IE	9.65	eV	Relay (1.0) Calculated Property
log10WS	-6.83		Relay (1.0) Calculated Property
logPoct/wat	7.380		Crippen Calculated Property
McVol	377.990	ml/mol	McGowan Calculated Property
Pc	771.60	kPa	Joback Calculated Property
Inp	[2855.00; 2871.00]
Inp	2855.00		NIST
Inp	2871.00		NIST
Tboil	650.35	K	Relay (1.0) Calculated Property
Tc	820.17	K	Relay (1.0) Calculated Property
Tfus	285.16	K	Relay (1.0) Calculated Property
Vc	1.465	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1262.56; 1364.13]	J/mol×K	[887.60; 1087.99]
Cp,gas	1262.56	J/mol×K	887.60	Joback Calculated Property
Cp,gas	1283.13	J/mol×K	921.00	Joback Calculated Property
Cp,gas	1302.20	J/mol×K	954.40	Joback Calculated Property
Cp,gas	1319.79	J/mol×K	987.80	Joback Calculated Property
Cp,gas	1335.95	J/mol×K	1021.20	Joback Calculated Property
Cp,gas	1350.72	J/mol×K	1054.59	Joback Calculated Property
Cp,gas	1364.13	J/mol×K	1087.99	Joback Calculated Property
η	[0.0000177; 0.0009393]	Pa×s	[441.17; 887.60]
η	0.0009393	Pa×s	441.17	Joback Calculated Property
η	0.0003007	Pa×s	515.57	Joback Calculated Property
η	0.0001283	Pa×s	589.98	Joback Calculated Property
η	0.0000663	Pa×s	664.38	Joback Calculated Property
η	0.0000391	Pa×s	738.79	Joback Calculated Property
η	0.0000254	Pa×s	813.19	Joback Calculated Property
η	0.0000177	Pa×s	887.60	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3-methylbutyl pentadecyl ester.

Sources

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

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