Chemical Properties of 2-(2-Butoxyethoxy)ethyl 2,2,3,3,4,4,4-heptafluorobutanoate

InChI

InChI=1S/C12H17F7O4/c1-2-3-4-21-5-6-22-7-8-23-9(20)10(13,14)11(15,16)12(17,18)19/h2-8H2,1H3

InChI Key

RGLAKFJGHIKBNF-UHFFFAOYSA-N

Formula

C12H17F7O4

SMILES

CCCCOCCOCCOC(=O)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

358.25

Other Names

• Diethylene glycol butyl ether, heptafluorobutyrate
• 3,6-Dioxaodec-1-yl heptafluorobutyrate

• 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	0.7387		Relay (... Calculated Property
ΔfG°	-1748.91	kJ/mol	Joback Calculated Property
ΔfH°gas	-2261.33	kJ/mol	Relay (... Calculated Property
ΔfusH°	31.32	kJ/mol	Joback Calculated Property
ΔvapH°	67.90	kJ/mol	Relay (... Calculated Property
IE	10.43	eV	Relay (... Calculated Property
log10WS	-3.77		Relay (... Calculated Property
logPoct/wat	3.196		Crippen Calculated Property
McVol	211.510	ml/mol	McGowan Calculated Property
Pc	1461.25	kPa	Joback Calculated Property
Inp	[1248.50; 1248.50]
Inp	1248.50		NIST
Inp	1248.50		NIST
Tboil	486.95	K	Relay (... Calculated Property
Tc	595.73	K	Relay (... Calculated Property
Tfus	196.62	K	Relay (... Calculated Property
Vc	0.798	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[585.51; 656.49]	J/mol×K	[580.29; 730.53]
Cp,gas	585.51	J/mol×K	580.29	Joback Calculated Property
Cp,gas	598.91	J/mol×K	605.33	Joback Calculated Property
Cp,gas	611.65	J/mol×K	630.37	Joback Calculated Property
Cp,gas	623.76	J/mol×K	655.41	Joback Calculated Property
Cp,gas	635.25	J/mol×K	680.45	Joback Calculated Property
Cp,gas	646.16	J/mol×K	705.49	Joback Calculated Property
Cp,gas	656.49	J/mol×K	730.53	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-Butoxyethoxy)ethyl 2,2,3,3,4,4,4-heptafluorobutanoate.

Sources

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

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