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

InChI

InChI=1S/C23H37F7O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-33-19(31)15-16-20(32)34-18-21(24,25)22(26,27)23(28,29)30/h2-18H2,1H3

InChI Key

JSEBMKRSYZHBIR-UHFFFAOYSA-N

Formula

C23H37F7O4

SMILES

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

Molecular Weight¹

510.53

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	1.1555		Relay (1.0) Calculated Property
ΔfG°	-1680.21	kJ/mol	Joback Calculated Property
ΔfH°gas	-2532.35	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	60.22	kJ/mol	Joback Calculated Property
ΔvapH°	110.15	kJ/mol	Relay (1.0) Calculated Property
IE	10.30	eV	Relay (1.0) Calculated Property
log10WS	-8.03		Relay (1.0) Calculated Property
logPoct/wat	7.777		Crippen Calculated Property
McVol	362.200	ml/mol	McGowan Calculated Property
Pc	775.05	kPa	Joback Calculated Property
Inp	[2334.00; 2334.00]
Inp	2334.00		NIST
Inp	2334.00		NIST
Tboil	619.87	K	Relay (1.0) Calculated Property
Tc	723.37	K	Relay (1.0) Calculated Property
Tfus	283.35	K	Relay (1.0) Calculated Property
Vc	1.377	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1205.88; 1300.45]	J/mol×K	[863.42; 1061.79]
Cp,gas	1205.88	J/mol×K	863.42	Joback Calculated Property
Cp,gas	1224.36	J/mol×K	896.48	Joback Calculated Property
Cp,gas	1241.65	J/mol×K	929.54	Joback Calculated Property
Cp,gas	1257.81	J/mol×K	962.61	Joback Calculated Property
Cp,gas	1272.95	J/mol×K	995.67	Joback Calculated Property
Cp,gas	1287.13	J/mol×K	1028.73	Joback Calculated Property
Cp,gas	1300.45	J/mol×K	1061.79	Joback Calculated Property

Similar Compounds

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

Sources

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

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