Chemical Properties of 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl acetate

InChI

InChI=1S/C29H58O15/c1-29(30)44-28-27-43-26-25-42-24-23-41-22-21-40-20-19-39-18-17-38-16-15-37-14-13-36-12-11-35-10-9-34-8-7-33-6-5-32-4-3-31-2/h3-28H2,1-2H3

InChI Key

OGUYMHYMIPZMFA-UHFFFAOYSA-N

Formula

C29H58O15

SMILES

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)=O

Molecular Weight¹

646.76

Other Names

• 3,6,9,12,15,18,21,24,27,30,33,36,39-Tridecaoxatetracont-1-yl acetate
• Tridecaethylene glycol monomethyl ether, acetate

• 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	1.7156		Relay (1.0) Calculated Property
ΔfG°	-1482.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-2538.29	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	90.68	kJ/mol	Joback Calculated Property
ΔvapH°	146.48	kJ/mol	Relay (1.0) Calculated Property
IE	9.60	eV	Relay (1.0) Calculated Property
log10WS	-0.37		Relay (1.0) Calculated Property
logPoct/wat	0.395		Crippen Calculated Property
McVol	503.220	ml/mol	McGowan Calculated Property
Pc	562.07	kPa	Joback Calculated Property
Inp	[4096.70; 4096.70]
Inp	4096.70		NIST
Inp	4096.70		NIST
Tboil	812.55	K	Relay (1.0) Calculated Property
Tc	959.21	K	Relay (1.0) Calculated Property
Tfus	202.47	K	Relay (1.0) Calculated Property
Vc	1.922	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[837.27; 1764.08]	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			3.33436e+02
Coefficient B			1.88244e+00
Coefficient C			-1.62000e-05
Coefficient D			-4.35600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	837.27	J/mol×K	273.00	Calculated Property
Cp,gas	978.09	J/mol×K	353.78	Calculated Property
Cp,gas	1112.66	J/mol×K	434.56	Calculated Property
Cp,gas	1239.60	J/mol×K	515.33	Calculated Property
Cp,gas	1357.55	J/mol×K	596.11	Calculated Property
Cp,gas	1465.12	J/mol×K	676.89	Calculated Property
Cp,gas	1560.94	J/mol×K	757.67	Calculated Property
Cp,gas	1643.62	J/mol×K	838.44	Calculated Property
Cp,gas	1711.79	J/mol×K	919.22	Calculated Property
Cp,gas	1764.08	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000033; 0.0000003]	Pa×s	[747.91; 1171.57]	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			-1.93260e+01
Coefficient B			5.01797e+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.			747.91
Temperature range, max.			1171.57
η	0.0000033	Pa×s	747.91	Calculated Property
η	0.0000022	Pa×s	794.98	Calculated Property
η	0.0000016	Pa×s	842.06	Calculated Property
η	0.0000011	Pa×s	889.13	Calculated Property
η	0.0000009	Pa×s	936.20	Calculated Property
η	0.0000007	Pa×s	983.28	Calculated Property
η	0.0000005	Pa×s	1030.35	Calculated Property
η	0.0000004	Pa×s	1077.42	Calculated Property
η	0.0000004	Pa×s	1124.50	Calculated Property
η	0.0000003	Pa×s	1171.57	Calculated Property

Similar Compounds

Find more compounds similar to 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]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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