Chemical Properties of Glutaric acid, 2,2,2-triluoroethyl propyl ester

InChI

InChI=1S/C10H15F3O4/c1-2-6-16-8(14)4-3-5-9(15)17-7-10(11,12)13/h2-7H2,1H3

InChI Key

YCHZWCBSMYBBAV-UHFFFAOYSA-N

Formula

C10H15F3O4

SMILES

CCCOC(=O)CCCC(=O)OCC(F)(F)F

Molecular Weight¹

256.22

• 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°	-1016.11	kJ/mol	Joback Calculated Property
ΔfH°gas	-1336.41	kJ/mol	Joback Calculated Property
ΔfusH°	29.06	kJ/mol	Joback Calculated Property
ΔvapH°	52.42	kJ/mol	Joback Calculated Property
log10WS	-2.40		Crippen Calculated Property
logPoct/wat	2.215		Crippen Calculated Property
McVol	171.950	ml/mol	McGowan Calculated Property
Pc	2062.36	kPa	Joback Calculated Property
Inp	[1214.00; 1214.00]
Inp	1214.00		NIST
Inp	1214.00		NIST
Tboil	575.36	K	Joback Calculated Property
Tc	742.77	K	Joback Calculated Property
Tfus	350.97	K	Joback Calculated Property
Vc	0.686	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[443.52; 508.43]	J/mol×K	[575.36; 742.77]
Cp,gas	443.52	J/mol×K	575.36	Joback Calculated Property
Cp,gas	455.70	J/mol×K	603.26	Joback Calculated Property
Cp,gas	467.32	J/mol×K	631.16	Joback Calculated Property
Cp,gas	478.40	J/mol×K	659.06	Joback Calculated Property
Cp,gas	488.93	J/mol×K	686.96	Joback Calculated Property
Cp,gas	498.94	J/mol×K	714.87	Joback Calculated Property
Cp,gas	508.43	J/mol×K	742.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,2-triluoroethyl propyl ester.

Sources

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

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