Chemical Properties of Diethyl docosanedioate

InChI

InChI=1S/C26H50O4/c1-3-29-25(27)23-21-19-17-15-13-11-9-7-5-6-8-10-12-14-16-18-20-22-24-26(28)30-4-2/h3-24H2,1-2H3

InChI Key

CRDQHLZIECEKFV-UHFFFAOYSA-N

Formula

C26H50O4

SMILES

CCOC(=O)CCCCCCCCCCCCCCCCCCCCC(=O)OCC

Molecular Weight¹

426.68

• 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	1.2510		Relay (1.0) Calculated Property
ΔfG°	-452.70	kJ/mol	Joback Calculated Property
ΔfH°gas	-1197.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	71.83	kJ/mol	Joback Calculated Property
ΔvapH°	134.17	kJ/mol	Relay (1.0) Calculated Property
IE	9.66	eV	Relay (1.0) Calculated Property
log10WS	-7.44		Relay (1.0) Calculated Property
logPoct/wat	7.915		Crippen Calculated Property
McVol	392.080	ml/mol	McGowan Calculated Property
Pc	728.88	kPa	Joback Calculated Property
Inp	[2995.00; 2995.00]
Inp	2995.00		NIST
Inp	2995.00		NIST
Tboil	647.76	K	Relay (1.0) Calculated Property
Tc	825.92	K	Relay (1.0) Calculated Property
Tfus	332.35	K	Relay (1.0) Calculated Property
Vc	1.541	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1325.89; 1429.41]	J/mol×K	[910.92; 1119.79]
Cp,gas	1325.89	J/mol×K	910.92	Joback Calculated Property
Cp,gas	1347.11	J/mol×K	945.73	Joback Calculated Property
Cp,gas	1366.67	J/mol×K	980.54	Joback Calculated Property
Cp,gas	1384.64	J/mol×K	1015.35	Joback Calculated Property
Cp,gas	1401.06	J/mol×K	1050.16	Joback Calculated Property
Cp,gas	1415.97	J/mol×K	1084.97	Joback Calculated Property
Cp,gas	1429.41	J/mol×K	1119.79	Joback Calculated Property
η	[0.0000165; 0.0006589]	Pa×s	[467.44; 910.92]
η	0.0006589	Pa×s	467.44	Joback Calculated Property
η	0.0002344	Pa×s	541.35	Joback Calculated Property
η	0.0001069	Pa×s	615.27	Joback Calculated Property
η	0.0000577	Pa×s	689.18	Joback Calculated Property
η	0.0000351	Pa×s	763.09	Joback Calculated Property
η	0.0000233	Pa×s	837.01	Joback Calculated Property
η	0.0000165	Pa×s	910.92	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethyl docosanedioate.

Sources

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

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