Chemical Properties of Succinic acid, 1,1,1-trifluoroprop-2-yl 1-cyclopentylethyl ester

InChI

InChI=1S/C14H21F3O4/c1-9(11-5-3-4-6-11)20-12(18)7-8-13(19)21-10(2)14(15,16)17/h9-11H,3-8H2,1-2H3

InChI Key

TXGJNSBWFOTQEU-UHFFFAOYSA-N

Formula

C14H21F3O4

SMILES

CC(OC(=O)CCC(=O)OC(C)C(F)(F)F)C1CCCC1

Molecular Weight¹

310.31

• 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°	-950.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-1369.05	kJ/mol	Joback Calculated Property
ΔfusH°	26.30	kJ/mol	Joback Calculated Property
ΔvapH°	60.80	kJ/mol	Joback Calculated Property
log10WS	-3.95		Crippen Calculated Property
logPoct/wat	3.383		Crippen Calculated Property
McVol	217.450	ml/mol	McGowan Calculated Property
Pc	1750.67	kPa	Joback Calculated Property
Inp	[1609.00; 1609.00]
Inp	1609.00		NIST
Inp	1609.00		NIST
Tboil	681.28	K	Joback Calculated Property
Tc	869.29	K	Joback Calculated Property
Tfus	376.95	K	Joback Calculated Property
Vc	0.840	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[640.13; 723.79]	J/mol×K	[681.28; 869.29]
Cp,gas	640.13	J/mol×K	681.28	Joback Calculated Property
Cp,gas	656.45	J/mol×K	712.62	Joback Calculated Property
Cp,gas	671.77	J/mol×K	743.95	Joback Calculated Property
Cp,gas	686.14	J/mol×K	775.29	Joback Calculated Property
Cp,gas	699.58	J/mol×K	806.62	Joback Calculated Property
Cp,gas	712.12	J/mol×K	837.96	Joback Calculated Property
Cp,gas	723.79	J/mol×K	869.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl 1-cyclopentylethyl ester.

Sources

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

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