Chemical Properties of Succinic acid, 2-fluorophenyl 2,2,3,4,4,4-hexafluorobutyl ester

InChI

InChI=1S/C14H11F7O4/c15-8-3-1-2-4-9(8)25-11(23)6-5-10(22)24-7-13(17,18)12(16)14(19,20)21/h1-4,12H,5-7H2

InChI Key

HVVQJZUQJXCHIM-UHFFFAOYSA-N

Formula

C14H11F7O4

SMILES

O=C(CCC(=O)Oc1ccccc1F)OCC(F)(F)C(F)C(F)(F)F

Molecular Weight¹

376.22

• 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	0.7567		Relay (1.0) Calculated Property
ΔfG°	-1658.49	kJ/mol	Joback Calculated Property
ΔfH°gas	-2095.88	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	34.45	kJ/mol	Joback Calculated Property
ΔvapH°	81.86	kJ/mol	Relay (1.0) Calculated Property
IE	9.35	eV	Relay (1.0) Calculated Property
log10WS	-4.77		Relay (1.0) Calculated Property
logPoct/wat	3.590		Crippen Calculated Property
McVol	211.630	ml/mol	McGowan Calculated Property
Pc	1703.31	kPa	Joback Calculated Property
Inp	[1662.00; 1662.00]
Inp	1662.00		NIST
Inp	1662.00		NIST
Tboil	544.24	K	Relay (1.0) Calculated Property
Tc	724.45	K	Relay (1.0) Calculated Property
Tfus	301.52	K	Relay (1.0) Calculated Property
Vc	0.775	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[601.50; 660.01]	J/mol×K	[691.95; 870.26]
Cp,gas	601.50	J/mol×K	691.95	Joback Calculated Property
Cp,gas	613.12	J/mol×K	721.67	Joback Calculated Property
Cp,gas	623.95	J/mol×K	751.39	Joback Calculated Property
Cp,gas	634.02	J/mol×K	781.10	Joback Calculated Property
Cp,gas	643.36	J/mol×K	810.82	Joback Calculated Property
Cp,gas	652.02	J/mol×K	840.54	Joback Calculated Property
Cp,gas	660.01	J/mol×K	870.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl 2,2,3,4,4,4-hexafluorobutyl ester.

Sources

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

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