Chemical Properties of 2-[2-(2-Ethoxyethoxy)ethoxy]ethyl 2,2,2-trifluoroacetate

InChI

InChI=1S/C10H17F3O5/c1-2-15-3-4-16-5-6-17-7-8-18-9(14)10(11,12)13/h2-8H2,1H3

InChI Key

BEWZRKTZWUVJLZ-UHFFFAOYSA-N

Formula

C10H17F3O5

SMILES

CCOCCOCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

274.23

Other Names

• Triethylene glycol monoethyl ether, trifluoroacetate
• 3,6,9-Trioxaundec-1-yl trifluoroacetate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-1525.34	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	31.42	kJ/mol	Joback Calculated Property
ΔvapH°	67.57	kJ/mol	Relay (1.0) Calculated Property
IE	10.38	eV	Relay (1.0) Calculated Property
log10WS	-0.48		Relay (1.0) Calculated Property
logPoct/wat	1.162		Crippen Calculated Property
McVol	182.120	ml/mol	McGowan Calculated Property
Pc	1826.28	kPa	Joback Calculated Property
Inp	[1278.00; 1278.00]
Inp	1278.00		NIST
Inp	1278.00		NIST
Tboil	498.18	K	Relay (1.0) Calculated Property
Tc	617.72	K	Relay (1.0) Calculated Property
Tfus	223.73	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[303.31; 621.53]	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			8.95070e+01
Coefficient B			8.70620e-01
Coefficient C			-3.13600e-04
Coefficient D			-2.50000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	303.31	J/mol×K	273.00	Calculated Property
Cp,gas	357.16	J/mol×K	353.78	Calculated Property
Cp,gas	406.57	J/mol×K	434.56	Calculated Property
Cp,gas	451.46	J/mol×K	515.33	Calculated Property
Cp,gas	491.76	J/mol×K	596.11	Calculated Property
Cp,gas	527.38	J/mol×K	676.89	Calculated Property
Cp,gas	558.25	J/mol×K	757.67	Calculated Property
Cp,gas	584.28	J/mol×K	838.44	Calculated Property
Cp,gas	605.40	J/mol×K	919.22	Calculated Property
Cp,gas	621.53	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2-[2-(2-Ethoxyethoxy)ethoxy]ethyl 2,2,2-trifluoroacetate.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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