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

InChI

InChI=1S/C19H33F3O4/c1-2-3-4-5-6-7-8-9-10-11-15-25-17(23)13-12-14-18(24)26-16-19(20,21)22/h2-16H2,1H3

InChI Key

MHUFPHWQGWVTLE-UHFFFAOYSA-N

Formula

C19H33F3O4

SMILES

CCCCCCCCCCCCOC(=O)CCCC(=O)OCC(F)(F)F

Molecular Weight¹

382.46

• 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°	-940.33	kJ/mol	Joback Calculated Property
ΔfH°gas	-1522.17	kJ/mol	Joback Calculated Property
ΔfusH°	52.37	kJ/mol	Joback Calculated Property
ΔvapH°	72.45	kJ/mol	Joback Calculated Property
log10WS	-6.16		Crippen Calculated Property
logPoct/wat	5.726		Crippen Calculated Property
McVol	298.760	ml/mol	McGowan Calculated Property
Pc	1063.79	kPa	Joback Calculated Property
Inp	[2115.00; 2115.00]
Inp	2115.00		NIST
Inp	2115.00		NIST
Tboil	781.28	K	Joback Calculated Property
Tc	957.97	K	Joback Calculated Property
Tfus	452.40	K	Joback Calculated Property
Vc	1.190	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[932.72; 1020.82]	J/mol×K	[781.28; 957.97]
Cp,gas	932.72	J/mol×K	781.28	Joback Calculated Property
Cp,gas	949.67	J/mol×K	810.73	Joback Calculated Property
Cp,gas	965.68	J/mol×K	840.18	Joback Calculated Property
Cp,gas	980.77	J/mol×K	869.62	Joback Calculated Property
Cp,gas	994.97	J/mol×K	899.07	Joback Calculated Property
Cp,gas	1008.31	J/mol×K	928.52	Joback Calculated Property
Cp,gas	1020.82	J/mol×K	957.97	Joback Calculated Property

Similar Compounds

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

Sources

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

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