Chemical Properties of Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl neopentyl ester

InChI

InChI=1S/C15H20F8O4/c1-12(2,3)7-26-9(24)5-4-6-10(25)27-8-13(18,19)15(22,23)14(20,21)11(16)17/h11H,4-8H2,1-3H3

InChI Key

YXAXICLINGOTIC-UHFFFAOYSA-N

Formula

C15H20F8O4

SMILES

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

Molecular Weight¹

416.30

• 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°	-1941.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-2451.69	kJ/mol	Joback Calculated Property
ΔfusH°	31.64	kJ/mol	Joback Calculated Property
ΔvapH°	55.19	kJ/mol	Joback Calculated Property
log10WS	-4.84		Crippen Calculated Property
logPoct/wat	4.460		Crippen Calculated Property
McVol	251.250	ml/mol	McGowan Calculated Property
Pc	1238.09	kPa	Joback Calculated Property
Inp	[1543.00; 1543.00]
Inp	1543.00		NIST
Inp	1543.00		NIST
Tboil	675.98	K	Joback Calculated Property
Tc	838.72	K	Joback Calculated Property
Tfus	402.53	K	Joback Calculated Property
Vc	1.018	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[750.53; 822.16]	J/mol×K	[675.98; 838.72]
Cp,gas	750.53	J/mol×K	675.98	Joback Calculated Property
Cp,gas	764.42	J/mol×K	703.10	Joback Calculated Property
Cp,gas	777.47	J/mol×K	730.23	Joback Calculated Property
Cp,gas	789.72	J/mol×K	757.35	Joback Calculated Property
Cp,gas	801.23	J/mol×K	784.47	Joback Calculated Property
Cp,gas	812.03	J/mol×K	811.59	Joback Calculated Property
Cp,gas	822.16	J/mol×K	838.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl neopentyl ester.

Sources

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

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