Chemical Properties of Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester

InChI

InChI=1S/C24H36F8O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-35-19(33)15-16-20(34)36-18-22(27,28)24(31,32)23(29,30)21(25)26/h15-16,21H,2-14,17-18H2,1H3/b16-15+

InChI Key

VZFGREUICPMQJL-FOCLMDBBSA-N

Formula

C24H36F8O4

SMILES

CCCCCCCCCCCCCCCOC(=O)C=CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

540.53

• 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°	-1788.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-2511.48	kJ/mol	Joback Calculated Property
ΔfusH°	62.57	kJ/mol	Joback Calculated Property
ΔvapH°	76.48	kJ/mol	Joback Calculated Property
log10WS	-8.70		Crippen Calculated Property
logPoct/wat	7.891		Crippen Calculated Property
McVol	373.760	ml/mol	McGowan Calculated Property
Pc	741.24	kPa	Joback Calculated Property
Inp	[2520.00; 2520.00]
Inp	2520.00		NIST
Inp	2520.00		NIST
Tboil	889.29	K	Joback Calculated Property
Tc	1096.45	K	Joback Calculated Property
Tfus	496.46	K	Joback Calculated Property
Vc	1.512	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1248.27; 1343.57]	J/mol×K	[889.29; 1096.45]
Cp,gas	1248.27	J/mol×K	889.29	Joback Calculated Property
Cp,gas	1266.75	J/mol×K	923.82	Joback Calculated Property
Cp,gas	1284.04	J/mol×K	958.34	Joback Calculated Property
Cp,gas	1300.25	J/mol×K	992.87	Joback Calculated Property
Cp,gas	1315.50	J/mol×K	1027.40	Joback Calculated Property
Cp,gas	1329.91	J/mol×K	1061.93	Joback Calculated Property
Cp,gas	1343.57	J/mol×K	1096.45	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester.

Sources

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

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