Chemical Properties of Ethanol, 2-[2-(2-methoxyethoxy)ethoxy]-, acetate (CAS 3610-27-3)

InChI

InChI=1S/C9H18O5/c1-9(10)14-8-7-13-6-5-12-4-3-11-2/h3-8H2,1-2H3

InChI Key

SDHQGBWMLCBNSM-UHFFFAOYSA-N

Formula

C9H18O5

SMILES

COCCOCCOCCOC(C)=O

Molecular Weight¹

206.24

CAS

3610-27-3

Other Names

• 2-(2-(2-Methoxyethoxy)ethoxy)ethyl acetate
• 2-(2-(2-Methoxyethoxy)ethoxy)ethylester kyseliny octove
• 3,6,9-Trioxadecylester kyseliny octove
• Acetic acid, 2-(2-(2-methoxyethoxy)ethoxy)ethyl ester
• Methyltriglycol acetate
• Triethylene 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	0.6923		Relay (1.0) Calculated Property
ΔfG°	-600.47	kJ/mol	Joback Calculated Property
ΔfH°gas	-916.35	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	27.00	kJ/mol	Joback Calculated Property
ΔvapH°	73.84	kJ/mol	Relay (1.0) Calculated Property
IE	9.56	eV	Relay (1.0) Calculated Property
log10WS	0.11		Relay (1.0) Calculated Property
logPoct/wat	0.229		Crippen Calculated Property
McVol	162.720	ml/mol	McGowan Calculated Property
Pc	2208.29	kPa	Joback Calculated Property
Inp	[1392.00; 1392.00]
Inp	1392.00		NIST
Inp	1392.00		NIST
Tboil	533.14	K	Relay (1.0) Calculated Property
Tc	697.36	K	Relay (1.0) Calculated Property
Tfus	234.59	K	Relay (1.0) Calculated Property
Vc	0.628	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[258.96; 547.26]	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			9.66160e+01
Coefficient B			6.14440e-01
Coefficient C			-3.82000e-05
Coefficient D			-1.25600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	258.96	J/mol×K	273.00	Calculated Property
Cp,gas	303.65	J/mol×K	353.78	Calculated Property
Cp,gas	346.10	J/mol×K	434.56	Calculated Property
Cp,gas	385.92	J/mol×K	515.33	Calculated Property
Cp,gas	422.71	J/mol×K	596.11	Calculated Property
Cp,gas	456.07	J/mol×K	676.89	Calculated Property
Cp,gas	485.60	J/mol×K	757.67	Calculated Property
Cp,gas	510.90	J/mol×K	838.44	Calculated Property
Cp,gas	531.59	J/mol×K	919.22	Calculated Property
Cp,gas	547.26	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0019230; 0.0001623]	Pa×s	[300.21; 490.34]	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			-1.26290e+01
Coefficient B			1.91387e+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.			300.21
Temperature range, max.			490.34
η	0.0019230	Pa×s	300.21	Calculated Property
η	0.0012646	Pa×s	321.34	Calculated Property
η	0.0008758	Pa×s	342.46	Calculated Property
η	0.0006330	Pa×s	363.59	Calculated Property
η	0.0004741	Pa×s	384.71	Calculated Property
η	0.0003659	Pa×s	405.84	Calculated Property
η	0.0002898	Pa×s	426.96	Calculated Property
η	0.0002346	Pa×s	448.09	Calculated Property
η	0.0001935	Pa×s	469.21	Calculated Property
η	0.0001623	Pa×s	490.34	Calculated Property

Similar Compounds

Find more compounds similar to Ethanol, 2-[2-(2-methoxyethoxy)ethoxy]-, acetate.

Sources

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

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