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

InChI

InChI=1S/C15H27F3O6/c1-13(2)3-4-20-5-6-21-7-8-22-9-10-23-11-12-24-14(19)15(16,17)18/h13H,3-12H2,1-2H3

InChI Key

YECGVPHJGUWBNM-UHFFFAOYSA-N

Formula

C15H27F3O6

SMILES

CC(C)CCOCCOCCOCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

360.37

• 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	0.8853		Relay (... Calculated Property
ΔfG°	-1162.53	kJ/mol	Joback Calculated Property
ΔfH°gas	-1762.36	kJ/mol	Relay (... Calculated Property
ΔfusH°	40.45	kJ/mol	Joback Calculated Property
ΔvapH°	81.06	kJ/mol	Relay (... Calculated Property
IE	10.21	eV	Relay (... Calculated Property
log10WS	-1.82		Relay (... Calculated Property
logPoct/wat	2.204		Crippen Calculated Property
McVol	258.440	ml/mol	McGowan Calculated Property
Pc	1286.51	kPa	Joback Calculated Property
Inp	[1800.80; 1800.80]
Inp	1800.80		NIST
Inp	1800.80		NIST
Tboil	571.19	K	Relay (... Calculated Property
Tc	685.22	K	Relay (... Calculated Property
Tfus	218.57	K	Relay (... Calculated Property
Vc	0.970	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[767.82; 851.51]	J/mol×K	[702.71; 868.34]
Cp,gas	767.82	J/mol×K	702.71	Joback Calculated Property
Cp,gas	783.69	J/mol×K	730.32	Joback Calculated Property
Cp,gas	798.80	J/mol×K	757.92	Joback Calculated Property
Cp,gas	813.14	J/mol×K	785.53	Joback Calculated Property
Cp,gas	826.71	J/mol×K	813.13	Joback Calculated Property
Cp,gas	839.50	J/mol×K	840.74	Joback Calculated Property
Cp,gas	851.51	J/mol×K	868.34	Joback Calculated Property

Similar Compounds

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

Sources

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

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