Chemical Properties of 2-[2-(2-Butoxyethoxy)ethoxy]ethyl 2,2,3,3,3-pentafluoropropanoate

InChI

InChI=1S/C13H21F5O5/c1-2-3-4-20-5-6-21-7-8-22-9-10-23-11(19)12(14,15)13(16,17)18/h2-10H2,1H3

InChI Key

BGBKSDBHTNZZQA-UHFFFAOYSA-N

Formula

C13H21F5O5

SMILES

CCCCOCCOCCOCCOC(=O)C(F)(F)C(F)(F)F

Molecular Weight¹

352.29

Other Names

• Triethylene glycol monobutyl ether, pentafluoropropionate
• 3,6,9-Trioxatridec-1-yl pentafluoropropionate

• 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).
• 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
ΔfG°	-1458.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-1951.16	kJ/mol	Joback Calculated Property
ΔfusH°	36.35	kJ/mol	Joback Calculated Property
ΔvapH°	54.24	kJ/mol	Joback Calculated Property
log10WS	-2.37		Crippen Calculated Property
logPoct/wat	2.577		Crippen Calculated Property
McVol	227.930	ml/mol	McGowan Calculated Property
Pc	1415.44	kPa	Joback Calculated Property
Inp	[1455.80; 1455.80]
Inp	1455.80		NIST
Inp	1455.80		NIST
Tboil	630.28	K	Joback Calculated Property
Tc	786.49	K	Joback Calculated Property
Tfus	382.91	K	Joback Calculated Property
Vc	0.909	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[646.58; 722.27]	J/mol×K	[630.28; 786.49]
Cp,gas	646.58	J/mol×K	630.28	Joback Calculated Property
Cp,gas	660.77	J/mol×K	656.32	Joback Calculated Property
Cp,gas	674.32	J/mol×K	682.35	Joback Calculated Property
Cp,gas	687.24	J/mol×K	708.39	Joback Calculated Property
Cp,gas	699.53	J/mol×K	734.42	Joback Calculated Property
Cp,gas	711.20	J/mol×K	760.46	Joback Calculated Property
Cp,gas	722.27	J/mol×K	786.49	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-[2-(2-Butoxyethoxy)ethoxy]ethyl 2,2,3,3,3-pentafluoropropanoate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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