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

InChI

InChI=1S/C15H22F6O4/c1-3-4-5-6-10(2)25-12(23)8-7-11(22)24-9-14(17,18)13(16)15(19,20)21/h10,13H,3-9H2,1-2H3

InChI Key

ZATAQUQZXJEFTG-UHFFFAOYSA-N

Formula

C15H22F6O4

SMILES

CCCCCC(C)OC(=O)CCC(=O)OCC(F)(F)C(F)C(F)(F)F

Molecular Weight¹

380.32

• 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°	-1560.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-2047.25	kJ/mol	Joback Calculated Property
ΔfusH°	36.79	kJ/mol	Joback Calculated Property
ΔvapH°	59.03	kJ/mol	Joback Calculated Property
log10WS	-4.88		Crippen Calculated Property
logPoct/wat	4.357		Crippen Calculated Property
McVol	247.710	ml/mol	McGowan Calculated Property
Pc	1292.07	kPa	Joback Calculated Property
Inp	[1571.00; 1571.00]
Inp	1571.00		NIST
Inp	1571.00		NIST
Tboil	683.46	K	Joback Calculated Property
Tc	847.03	K	Joback Calculated Property
Tfus	381.51	K	Joback Calculated Property
Vc	0.998	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[730.14; 805.36]	J/mol×K	[683.46; 847.03]
Cp,gas	730.14	J/mol×K	683.46	Joback Calculated Property
Cp,gas	744.53	J/mol×K	710.72	Joback Calculated Property
Cp,gas	758.14	J/mol×K	737.98	Joback Calculated Property
Cp,gas	771.00	J/mol×K	765.25	Joback Calculated Property
Cp,gas	783.14	J/mol×K	792.51	Joback Calculated Property
Cp,gas	794.59	J/mol×K	819.77	Joback Calculated Property
Cp,gas	805.36	J/mol×K	847.03	Joback Calculated Property

Similar Compounds

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

Sources

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

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