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

InChI

InChI=1S/C17H24F8O4/c1-9(2)13(10(3)4)29-12(27)7-5-6-11(26)28-8-15(20,21)17(24,25)16(22,23)14(18)19/h9-10,13-14H,5-8H2,1-4H3

InChI Key

UZIDACGAFYRLDO-UHFFFAOYSA-N

Formula

C17H24F8O4

SMILES

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

Molecular Weight¹

444.36

• 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	0.8378		Relay (1.0) Calculated Property
ΔfG°	-1935.30	kJ/mol	Joback Calculated Property
ΔfH°gas	-2592.65	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	33.67	kJ/mol	Joback Calculated Property
ΔvapH°	82.71	kJ/mol	Relay (1.0) Calculated Property
IE	9.94	eV	Relay (1.0) Calculated Property
log10WS	-5.70		Relay (1.0) Calculated Property
logPoct/wat	5.095		Crippen Calculated Property
McVol	279.430	ml/mol	McGowan Calculated Property
Pc	1089.94	kPa	Joback Calculated Property
Inp	[1675.00; 1675.00]
Inp	1675.00		NIST
Inp	1675.00		NIST
Tboil	568.24	K	Relay (1.0) Calculated Property
Tc	697.59	K	Relay (1.0) Calculated Property
Tfus	289.79	K	Relay (1.0) Calculated Property
Vc	1.039	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[860.44; 937.82]	J/mol×K	[723.65; 890.76]
Cp,gas	860.44	J/mol×K	723.65	Joback Calculated Property
Cp,gas	875.43	J/mol×K	751.50	Joback Calculated Property
Cp,gas	889.52	J/mol×K	779.35	Joback Calculated Property
Cp,gas	902.77	J/mol×K	807.20	Joback Calculated Property
Cp,gas	915.20	J/mol×K	835.06	Joback Calculated Property
Cp,gas	926.87	J/mol×K	862.91	Joback Calculated Property
Cp,gas	937.82	J/mol×K	890.76	Joback Calculated Property

Similar Compounds

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

Sources

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

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