Chemical Properties of 2-(2-nonyloxy-ethoxy)-ethanol, TFA

InChI

InChI=1S/C15H27F3O4/c1-2-3-4-5-6-7-8-9-20-10-11-21-12-13-22-14(19)15(16,17)18/h2-13H2,1H3

InChI Key

VWNSWHYYVKPJSN-UHFFFAOYSA-N

Formula

C15H27F3O4

SMILES

CCCCCCCCCOCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

328.37

• ω : Acentric Factor.
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.8463		Relay (1.0) Calculated Property
ΔfH°gas	-1494.64	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	43.18	kJ/mol	Joback Calculated Property
ΔvapH°	82.88	kJ/mol	Relay (1.0) Calculated Property
IE	10.26	eV	Relay (1.0) Calculated Property
log10WS	-3.64		Relay (1.0) Calculated Property
logPoct/wat	3.876		Crippen Calculated Property
McVol	246.700	ml/mol	McGowan Calculated Property
Pc	1272.78	kPa	Joback Calculated Property
Inp	[1707.10; 1707.10]
Inp	1707.10		NIST
Inp	1707.10		NIST
Tboil	548.50	K	Relay (1.0) Calculated Property
Tc	671.23	K	Relay (1.0) Calculated Property
Tfus	240.92	K	Relay (1.0) Calculated Property
Vc	0.943	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[699.46; 785.54]	J/mol×K	[640.44; 798.13]
Cp,gas	699.46	J/mol×K	640.44	Joback Calculated Property
Cp,gas	715.57	J/mol×K	666.72	Joback Calculated Property
Cp,gas	730.95	J/mol×K	693.00	Joback Calculated Property
Cp,gas	745.64	J/mol×K	719.28	Joback Calculated Property
Cp,gas	759.62	J/mol×K	745.56	Joback Calculated Property
Cp,gas	772.92	J/mol×K	771.84	Joback Calculated Property
Cp,gas	785.54	J/mol×K	798.13	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-nonyloxy-ethoxy)-ethanol, TFA.

Sources

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

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