Chemical Properties of 2-Butoxyethyl 2,2,2-trifluoroacetate

InChI

InChI=1S/C8H13F3O3/c1-2-3-4-13-5-6-14-7(12)8(9,10)11/h2-6H2,1H3

InChI Key

NIMPJBNMRJJAEE-UHFFFAOYSA-N

Formula

C8H13F3O3

SMILES

CCCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

214.18

Other Names

• 2-Butoxyethanol, trifluoroacetate

• 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	0.5412		Relay (1.0) Calculated Property
ΔfG°	-980.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-1226.44	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.86	kJ/mol	Joback Calculated Property
ΔvapH°	52.85	kJ/mol	Relay (1.0) Calculated Property
IE	10.62	eV	Relay (1.0) Calculated Property
log10WS	-1.02		Relay (1.0) Calculated Property
logPoct/wat	1.909		Crippen Calculated Property
McVol	142.200	ml/mol	McGowan Calculated Property
Pc	2237.64	kPa	Joback Calculated Property
Inp	[948.50; 953.70]
Inp	953.70		NIST
Inp	948.50		NIST
Inp	948.50		NIST
Tboil	434.67	K	Relay (1.0) Calculated Property
Tc	556.75	K	Relay (1.0) Calculated Property
Tfus	200.39	K	Relay (1.0) Calculated Property
Vc	0.536	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[326.19; 389.37]	J/mol×K	[457.86; 615.04]
Cp,gas	326.19	J/mol×K	457.86	Joback Calculated Property
Cp,gas	337.86	J/mol×K	484.06	Joback Calculated Property
Cp,gas	349.07	J/mol×K	510.25	Joback Calculated Property
Cp,gas	359.81	J/mol×K	536.45	Joback Calculated Property
Cp,gas	370.11	J/mol×K	562.64	Joback Calculated Property
Cp,gas	379.96	J/mol×K	588.84	Joback Calculated Property
Cp,gas	389.37	J/mol×K	615.04	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Butoxyethyl 2,2,2-trifluoroacetate.

Sources

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

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