Chemical Properties of Succinic acid, ethyl 1-(pentafluorophenyl)ethyl ester

InChI

InChI=1S/C14H13F5O4/c1-3-22-7(20)4-5-8(21)23-6(2)9-10(15)12(17)14(19)13(18)11(9)16/h6H,3-5H2,1-2H3

InChI Key

OVUCRNDGRPPRSX-UHFFFAOYSA-N

Formula

C14H13F5O4

SMILES

CCOC(=O)CCC(=O)OC(C)c1c(F)c(F)c(F)c(F)c1F

Molecular Weight¹

340.24

• 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°	-1313.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-1628.54	kJ/mol	Joback Calculated Property
ΔfusH°	41.56	kJ/mol	Joback Calculated Property
ΔvapH°	66.18	kJ/mol	Joback Calculated Property
log10WS	-4.63		Crippen Calculated Property
logPoct/wat	3.330		Crippen Calculated Property
McVol	208.090	ml/mol	McGowan Calculated Property
Pc	1692.12	kPa	Joback Calculated Property
Inp	[1636.00; 1636.00]
Inp	1636.00		NIST
Inp	1636.00		NIST
Tboil	719.79	K	Joback Calculated Property
Tc	899.93	K	Joback Calculated Property
Tfus	468.83	K	Joback Calculated Property
Vc	0.844	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[576.00; 635.98]	J/mol×K	[719.79; 899.93]
Cp,gas	576.00	J/mol×K	719.79	Joback Calculated Property
Cp,gas	587.63	J/mol×K	749.81	Joback Calculated Property
Cp,gas	598.62	J/mol×K	779.84	Joback Calculated Property
Cp,gas	608.96	J/mol×K	809.86	Joback Calculated Property
Cp,gas	618.63	J/mol×K	839.88	Joback Calculated Property
Cp,gas	627.64	J/mol×K	869.91	Joback Calculated Property
Cp,gas	635.98	J/mol×K	899.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, ethyl 1-(pentafluorophenyl)ethyl ester.

Sources

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

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