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

InChI

InChI=1S/C27H54O14/c1-27(28)41-26-25-40-24-23-39-22-21-38-20-19-37-18-17-36-16-15-35-14-13-34-12-11-33-10-9-32-8-7-31-6-5-30-4-3-29-2/h3-26H2,1-2H3

InChI Key

JZKOCISBWDSMFA-UHFFFAOYSA-N

Formula

C27H54O14

SMILES

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(C)=O

Molecular Weight¹

602.71

Other Names

• Dodecaethylene glycol monomethyl ether, acetate
• 3,6,9,12,15,18,21,24,27,30,33,36-Dodecaoxaheptatriacont-1-yl 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	1.6148		Relay (1.0) Calculated Property
ΔfG°	-1393.91	kJ/mol	Joback Calculated Property
ΔfH°gas	-2377.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	84.31	kJ/mol	Joback Calculated Property
ΔvapH°	139.82	kJ/mol	Relay (1.0) Calculated Property
IE	9.57	eV	Relay (1.0) Calculated Property
log10WS	-0.37		Relay (1.0) Calculated Property
logPoct/wat	0.379		Crippen Calculated Property
McVol	469.170	ml/mol	McGowan Calculated Property
Pc	622.20	kPa	Joback Calculated Property
Inp	[3817.60; 3817.60]
Inp	3817.60		NIST
Inp	3817.60		NIST
Tboil	787.88	K	Relay (1.0) Calculated Property
Tc	936.78	K	Relay (1.0) Calculated Property
Tfus	208.93	K	Relay (1.0) Calculated Property
Vc	1.794	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[779.44; 1642.39]	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			3.09754e+02
Coefficient B			1.75564e+00
Coefficient C			-1.84000e-05
Coefficient D			-4.04600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	779.44	J/mol×K	273.00	Calculated Property
Cp,gas	910.64	J/mol×K	353.78	Calculated Property
Cp,gas	1036.00	J/mol×K	434.56	Calculated Property
Cp,gas	1154.24	J/mol×K	515.33	Calculated Property
Cp,gas	1264.07	J/mol×K	596.11	Calculated Property
Cp,gas	1364.22	J/mol×K	676.89	Calculated Property
Cp,gas	1453.40	J/mol×K	757.67	Calculated Property
Cp,gas	1530.35	J/mol×K	838.44	Calculated Property
Cp,gas	1593.77	J/mol×K	919.22	Calculated Property
Cp,gas	1642.39	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000067; 0.0000007]	Pa×s	[703.14; 1061.51]	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			-1.86126e+01
Coefficient B			4.70756e+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.			703.14
Temperature range, max.			1061.51
η	0.0000067	Pa×s	703.14	Calculated Property
η	0.0000047	Pa×s	742.96	Calculated Property
η	0.0000034	Pa×s	782.78	Calculated Property
η	0.0000025	Pa×s	822.60	Calculated Property
η	0.0000019	Pa×s	862.42	Calculated Property
η	0.0000015	Pa×s	902.23	Calculated Property
η	0.0000012	Pa×s	942.05	Calculated Property
η	0.0000010	Pa×s	981.87	Calculated Property
η	0.0000008	Pa×s	1021.69	Calculated Property
η	0.0000007	Pa×s	1061.51	Calculated Property

Similar Compounds

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