Chemical Properties of Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl tetradecyl ester

InChI

InChI=1S/C22H35F7O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-32-18(30)14-15-19(31)33-17-20(23,24)21(25,26)22(27,28)29/h2-17H2,1H3

InChI Key

FOVKHQQJGXUGIO-UHFFFAOYSA-N

Formula

C22H35F7O4

SMILES

CCCCCCCCCCCCCCOC(=O)CCC(=O)OCC(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

496.50

• 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	1.1193		Relay (1.0) Calculated Property
ΔfG°	-1688.63	kJ/mol	Joback Calculated Property
ΔfH°gas	-2512.88	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	57.63	kJ/mol	Joback Calculated Property
ΔvapH°	106.31	kJ/mol	Relay (1.0) Calculated Property
IE	10.28	eV	Relay (1.0) Calculated Property
log10WS	-7.76		Relay (1.0) Calculated Property
logPoct/wat	7.387		Crippen Calculated Property
McVol	348.110	ml/mol	McGowan Calculated Property
Pc	818.20	kPa	Joback Calculated Property
Inp	[2242.00; 2242.00]
Inp	2242.00		NIST
Inp	2242.00		NIST
Tboil	610.74	K	Relay (1.0) Calculated Property
Tc	714.50	K	Relay (1.0) Calculated Property
Tfus	279.39	K	Relay (1.0) Calculated Property
Vc	1.324	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1144.76; 1235.91]	J/mol×K	[840.54; 1031.22]
Cp,gas	1144.76	J/mol×K	840.54	Joback Calculated Property
Cp,gas	1162.51	J/mol×K	872.32	Joback Calculated Property
Cp,gas	1179.14	J/mol×K	904.10	Joback Calculated Property
Cp,gas	1194.72	J/mol×K	935.88	Joback Calculated Property
Cp,gas	1209.33	J/mol×K	967.66	Joback Calculated Property
Cp,gas	1223.03	J/mol×K	999.44	Joback Calculated Property
Cp,gas	1235.91	J/mol×K	1031.22	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl tetradecyl ester.

Sources

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

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