Chemical Properties of Diethylmalonic acid, 2-methoxyethyl nonyl ester

InChI

InChI=1S/C19H36O5/c1-5-8-9-10-11-12-13-14-23-17(20)19(6-2,7-3)18(21)24-16-15-22-4/h5-16H2,1-4H3

InChI Key

OUEDBPWYDQXDMN-UHFFFAOYSA-N

Formula

C19H36O5

SMILES

CCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCCOC

Molecular Weight¹

344.49

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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	0.9299		Relay (1.0) Calculated Property
ΔfH°gas	-1138.83	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	47.48	kJ/mol	Joback Calculated Property
ΔvapH°	94.78	kJ/mol	Relay (1.0) Calculated Property
IE	9.35	eV	Relay (1.0) Calculated Property
log10WS	-4.24		Relay (1.0) Calculated Property
logPoct/wat	4.276		Crippen Calculated Property
McVol	299.320	ml/mol	McGowan Calculated Property
Pc	1089.22	kPa	Joback Calculated Property
Inp	[2091.00; 2091.00]
Inp	2091.00		NIST
Inp	2091.00		NIST
Tboil	603.25	K	Relay (1.0) Calculated Property
Tc	787.28	K	Relay (1.0) Calculated Property
Tfus	269.33	K	Relay (1.0) Calculated Property
Vc	1.103	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[925.28; 1016.78]	J/mol×K	[769.95; 950.00]
Cp,gas	925.28	J/mol×K	769.95	Joback Calculated Property
Cp,gas	943.16	J/mol×K	799.96	Joback Calculated Property
Cp,gas	959.97	J/mol×K	829.97	Joback Calculated Property
Cp,gas	975.71	J/mol×K	859.98	Joback Calculated Property
Cp,gas	990.42	J/mol×K	889.99	Joback Calculated Property
Cp,gas	1004.10	J/mol×K	920.00	Joback Calculated Property
Cp,gas	1016.78	J/mol×K	950.00	Joback Calculated Property
η	[0.0000297; 0.0011250]	Pa×s	[413.20; 769.95]
η	0.0011250	Pa×s	413.20	Joback Calculated Property
η	0.0004194	Pa×s	472.66	Joback Calculated Property
η	0.0001949	Pa×s	532.12	Joback Calculated Property
η	0.0001056	Pa×s	591.58	Joback Calculated Property
η	0.0000641	Pa×s	651.03	Joback Calculated Property
η	0.0000422	Pa×s	710.49	Joback Calculated Property
η	0.0000297	Pa×s	769.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylmalonic acid, 2-methoxyethyl nonyl ester.

Sources

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

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