Chemical Properties of 2-(2-(2-(2-(2-(2-(2-Isobutoxy-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethyl acetate

InChI

InChI=1S/C22H44O10/c1-21(2)20-31-17-16-29-13-12-27-9-8-25-5-4-24-6-7-26-10-11-28-14-15-30-18-19-32-22(3)23/h21H,4-20H2,1-3H3

InChI Key

JBMAVCLRPVPEGL-UHFFFAOYSA-N

Formula

C22H44O10

SMILES

CC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCC(C)C

Molecular Weight¹

468.58

• 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	1.2841		Relay (1.0) Calculated Property
ΔfH°gas	-1812.16	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	63.09	kJ/mol	Joback Calculated Property
ΔvapH°	115.68	kJ/mol	Relay (1.0) Calculated Property
IE	9.33	eV	Relay (1.0) Calculated Property
log10WS	-1.42		Relay (1.0) Calculated Property
logPoct/wat	1.338		Crippen Calculated Property
McVol	375.240	ml/mol	McGowan Calculated Property
Pc	838.70	kPa	Joback Calculated Property
Inp	[3060.60; 3060.60]
Inp	3060.60		NIST
Inp	3060.60		NIST
Tboil	705.03	K	Relay (1.0) Calculated Property
Tc	852.52	K	Relay (1.0) Calculated Property
Tfus	214.78	K	Relay (1.0) Calculated Property
Vc	1.431	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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[611.44; 1310.98]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			2.10617e+02
Coefficient B			1.53936e+00
Coefficient C			-1.93600e-04
Coefficient D			-2.45400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	611.44	J/mol×K	273.00	Calculated Property
Cp,gas	720.11	J/mol×K	353.78	Calculated Property
Cp,gas	822.86	J/mol×K	434.56	Calculated Property
Cp,gas	918.90	J/mol×K	515.33	Calculated Property
Cp,gas	1007.47	J/mol×K	596.11	Calculated Property
Cp,gas	1087.78	J/mol×K	676.89	Calculated Property
Cp,gas	1159.07	J/mol×K	757.67	Calculated Property
Cp,gas	1220.54	J/mol×K	838.44	Calculated Property
Cp,gas	1271.44	J/mol×K	919.22	Calculated Property
Cp,gas	1310.98	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000760; 0.0000075]	Pa×s	[542.87; 812.02]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.64593e+01
Coefficient B			3.78622e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			542.87
Temperature range, max.			812.02
η	0.0000760	Pa×s	542.87	Calculated Property
η	0.0000528	Pa×s	572.78	Calculated Property
η	0.0000380	Pa×s	602.68	Calculated Property
η	0.0000283	Pa×s	632.59	Calculated Property
η	0.0000216	Pa×s	662.49	Calculated Property
η	0.0000169	Pa×s	692.40	Calculated Property
η	0.0000134	Pa×s	722.31	Calculated Property
η	0.0000109	Pa×s	752.21	Calculated Property
η	0.0000090	Pa×s	782.12	Calculated Property
η	0.0000075	Pa×s	812.02	Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-(2-(2-(2-(2-(2-Isobutoxy-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethyl acetate.

Sources

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

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