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

InChI

InChI=1S/C26H49F3O9/c1-2-3-4-5-6-7-8-9-10-31-11-12-32-13-14-33-15-16-34-17-18-35-19-20-36-21-22-37-23-24-38-25(30)26(27,28)29/h2-24H2,1H3

InChI Key

JXZNCKAJDHXPHL-UHFFFAOYSA-N

Formula

C26H49F3O9

SMILES

CCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

562.66

• 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	1.4072		Relay (1.0) Calculated Property
ΔfH°gas	-2330.04	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	77.61	kJ/mol	Joback Calculated Property
ΔvapH°	125.26	kJ/mol	Relay (1.0) Calculated Property
IE	10.17	eV	Relay (1.0) Calculated Property
log10WS	-4.11		Relay (1.0) Calculated Property
logPoct/wat	4.349		Crippen Calculated Property
McVol	431.040	ml/mol	McGowan Calculated Property
Pc	642.87	kPa	Joback Calculated Property
Inp	[3223.10; 3223.10]
Inp	3223.10		NIST
Inp	3223.10		NIST
Tboil	713.74	K	Relay (1.0) Calculated Property
Tc	811.28	K	Relay (1.0) Calculated Property
Tfus	229.13	K	Relay (1.0) Calculated Property
Vc	1.638	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	[1523.06; 1588.20]	J/mol×K	[1004.22; 1275.65]
Cp,gas	1523.06	J/mol×K	1004.22	Joback Calculated Property
Cp,gas	1543.32	J/mol×K	1049.46	Joback Calculated Property
Cp,gas	1559.86	J/mol×K	1094.70	Joback Calculated Property
Cp,gas	1572.65	J/mol×K	1139.93	Joback Calculated Property
Cp,gas	1581.66	J/mol×K	1185.17	Joback Calculated Property
Cp,gas	1586.85	J/mol×K	1230.41	Joback Calculated Property
Cp,gas	1588.20	J/mol×K	1275.65	Joback Calculated Property

Similar Compounds

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

Sources

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

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