Chemical Properties of 2-(2-(2-(2-(2-(2-Pentoxy-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethyl trifluoroacetate

InChI

InChI=1S/C21H39F3O9/c1-2-3-4-5-26-6-7-27-8-9-28-10-11-29-12-13-30-14-15-31-16-17-32-18-19-33-20(25)21(22,23)24/h2-19H2,1H3

InChI Key

CMWOUJVTVQBCJZ-UHFFFAOYSA-N

Formula

C21H39F3O9

SMILES

CCCCCOCCOCCOCCOCCOCCOCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

492.52

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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	1.2311		Relay (... Calculated Property
ΔfG°	-1424.57	kJ/mol	Joback Calculated Property
ΔfH°gas	-2233.18	kJ/mol	Relay (... Calculated Property
ΔfusH°	63.07	kJ/mol	Joback Calculated Property
ΔvapH°	105.15	kJ/mol	Relay (... Calculated Property
IE	10.19	eV	Relay (... Calculated Property
log10WS	-1.99		Relay (... Calculated Property
logPoct/wat	2.398		Crippen Calculated Property
McVol	360.590	ml/mol	McGowan Calculated Property
Pc	853.47	kPa	Joback Calculated Property
Inp	[2629.60; 2629.60]
Inp	2629.60		NIST
Inp	2629.60		NIST
Tboil	672.69	K	Relay (... Calculated Property
Tc	767.49	K	Relay (... Calculated Property
Tfus	210.01	K	Relay (... Calculated Property
Vc	1.367	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1218.80; 1299.07]	J/mol×K	[907.69; 1121.00]
Cp,gas	1218.80	J/mol×K	907.69	Joback Calculated Property
Cp,gas	1237.17	J/mol×K	943.24	Joback Calculated Property
Cp,gas	1253.59	J/mol×K	978.79	Joback Calculated Property
Cp,gas	1268.02	J/mol×K	1014.34	Joback Calculated Property
Cp,gas	1280.43	J/mol×K	1049.89	Joback Calculated Property
Cp,gas	1290.79	J/mol×K	1085.45	Joback Calculated Property
Cp,gas	1299.07	J/mol×K	1121.00	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-(2-(2-(2-(2-Pentoxy-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethoxy)-ethyl trifluoroacetate.

Sources

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

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