Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-methylbut-2-yl ester

InChI

InChI=1S/C13H20F4O4/c1-8(2)9(3)21-11(19)6-4-5-10(18)20-7-13(16,17)12(14)15/h8-9,12H,4-7H2,1-3H3

InChI Key

OJUBNHICEBAOKN-UHFFFAOYSA-N

Formula

C13H20F4O4

SMILES

CC(C)C(C)OC(=O)CCCC(=O)OCC(F)(F)C(F)F

Molecular Weight¹

316.29

• 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°	-1192.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-1610.28	kJ/mol	Joback Calculated Property
ΔfusH°	29.34	kJ/mol	Joback Calculated Property
ΔvapH°	57.12	kJ/mol	Joback Calculated Property
log10WS	-3.49		Crippen Calculated Property
logPoct/wat	3.188		Crippen Calculated Property
McVol	215.990	ml/mol	McGowan Calculated Property
Pc	1586.01	kPa	Joback Calculated Property
Inp	[1447.00; 1447.00]
Inp	1447.00		NIST
Inp	1447.00		NIST
Tboil	641.95	K	Joback Calculated Property
Tc	809.65	K	Joback Calculated Property
Tfus	340.37	K	Joback Calculated Property
Vc	0.855	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[604.46; 679.18]	J/mol×K	[641.95; 809.65]
Cp,gas	604.46	J/mol×K	641.95	Joback Calculated Property
Cp,gas	618.64	J/mol×K	669.90	Joback Calculated Property
Cp,gas	632.11	J/mol×K	697.85	Joback Calculated Property
Cp,gas	644.88	J/mol×K	725.80	Joback Calculated Property
Cp,gas	656.97	J/mol×K	753.75	Joback Calculated Property
Cp,gas	668.40	J/mol×K	781.70	Joback Calculated Property
Cp,gas	679.18	J/mol×K	809.65	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-methylbut-2-yl ester.

Sources

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

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