Chemical Properties of Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexadecyl ester

InChI

InChI=1S/C24H39F7O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-34-20(32)16-17-21(33)35-19-22(25,26)23(27,28)24(29,30)31/h2-19H2,1H3

InChI Key

BRIKPZVAWMXZAY-UHFFFAOYSA-N

Formula

C24H39F7O4

SMILES

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

Molecular Weight¹

524.55

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-2551.82	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	65.97	kJ/mol	Joback Calculated Property
ΔvapH°	114.86	kJ/mol	Relay (1.0) Calculated Property
log10WS	-8.29		Relay (1.0) Calculated Property
logPoct/wat	8.167		Crippen Calculated Property
McVol	376.290	ml/mol	McGowan Calculated Property
Pc	703.59	kPa	Joback Calculated Property
Inp	[2425.00; 2425.00]
Inp	2425.00		NIST
Inp	2425.00		NIST
Tboil	628.65	K	Relay (1.0) Calculated Property
Tc	736.15	K	Relay (1.0) Calculated Property
Tfus	285.43	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[600.30; 1327.63]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.10800e+00
Coefficient B			2.63422e+00
Coefficient C			-1.72280e-03
Coefficient D			4.15100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	600.30	J/mol×K	273.00	Calculated Property
Cp,gas	735.79	J/mol×K	353.78	Calculated Property
Cp,gas	854.56	J/mol×K	434.56	Calculated Property
Cp,gas	957.90	J/mol×K	515.33	Calculated Property
Cp,gas	1047.13	J/mol×K	596.11	Calculated Property
Cp,gas	1123.57	J/mol×K	676.89	Calculated Property
Cp,gas	1188.53	J/mol×K	757.67	Calculated Property
Cp,gas	1243.31	J/mol×K	838.44	Calculated Property
Cp,gas	1289.24	J/mol×K	919.22	Calculated Property
Cp,gas	1327.63	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexadecyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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