Chemical Properties of 2-[2-(2,2,3,3,4,4,4-Heptafluorobutanoyl)oxyethoxy]ethyl 2,2,3,3,4,4,4-heptafluorobutanoate

InChI

InChI=1S/C12H8F14O5/c13-7(14,9(17,18)11(21,22)23)5(27)30-3-1-29-2-4-31-6(28)8(15,16)10(19,20)12(24,25)26/h1-4H2

InChI Key

BEEXQHZRCIFGJK-UHFFFAOYSA-N

Formula

C12H8F14O5

SMILES

O=C(OCCOCCOC(=O)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

498.17

Other Names

• 8,8,9,9,10,10,10-Heptafluoro-7-oxo-3,6-dioxadec-1-yl Heptafluorobutyrate
• Diethylene glycol, bis(heptafluorobutyrate)

• 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°	-3232.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-3710.87	kJ/mol	Joback Calculated Property
ΔfusH°	32.23	kJ/mol	Joback Calculated Property
ΔvapH°	43.81	kJ/mol	Joback Calculated Property
log10WS	-4.24		Crippen Calculated Property
logPoct/wat	3.755		Crippen Calculated Property
McVol	225.470	ml/mol	McGowan Calculated Property
Pc	1265.55	kPa	Joback Calculated Property
Inp	[1106.60; 1106.60]
Inp	1106.60		NIST
Inp	1106.60		NIST
Tboil	619.36	K	Joback Calculated Property
Tc	765.02	K	Joback Calculated Property
Tfus	414.33	K	Joback Calculated Property
Vc	0.960	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[674.09; 729.06]	J/mol×K	[619.36; 765.02]
Cp,gas	674.09	J/mol×K	619.36	Joback Calculated Property
Cp,gas	684.99	J/mol×K	643.64	Joback Calculated Property
Cp,gas	695.14	J/mol×K	667.91	Joback Calculated Property
Cp,gas	704.58	J/mol×K	692.19	Joback Calculated Property
Cp,gas	713.36	J/mol×K	716.47	Joback Calculated Property
Cp,gas	721.50	J/mol×K	740.74	Joback Calculated Property
Cp,gas	729.06	J/mol×K	765.02	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-[2-(2,2,3,3,4,4,4-Heptafluorobutanoyl)oxyethoxy]ethyl 2,2,3,3,4,4,4-heptafluorobutanoate.

Sources

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

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