Chemical Properties of Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 1-phenylpropyl ester

InChI

InChI=1S/C18H18F8O4/c1-2-12(11-6-4-3-5-7-11)30-14(28)9-8-13(27)29-10-16(21,22)18(25,26)17(23,24)15(19)20/h3-7,12,15H,2,8-10H2,1H3

InChI Key

LSXXJSZBNZCDOL-UHFFFAOYSA-N

Formula

C18H18F8O4

SMILES

CCC(OC(=O)CCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1

Molecular Weight¹

450.32

• 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°	-1809.59	kJ/mol	Joback Calculated Property
ΔfH°gas	-2273.61	kJ/mol	Joback Calculated Property
ΔfusH°	37.34	kJ/mol	Joback Calculated Property
ΔvapH°	65.05	kJ/mol	Joback Calculated Property
log10WS	-5.90		Crippen Calculated Property
logPoct/wat	5.175		Crippen Calculated Property
McVol	269.760	ml/mol	McGowan Calculated Property
Pc	1266.45	kPa	Joback Calculated Property
Inp	[1878.00; 1878.00]
Inp	1878.00		NIST
Inp	1878.00		NIST
Tboil	774.09	K	Joback Calculated Property
Tc	956.40	K	Joback Calculated Property
Tfus	445.34	K	Joback Calculated Property
Vc	1.083	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[829.11; 894.74]	J/mol×K	[774.09; 956.40]
Cp,gas	829.11	J/mol×K	774.09	Joback Calculated Property
Cp,gas	842.20	J/mol×K	804.48	Joback Calculated Property
Cp,gas	854.35	J/mol×K	834.86	Joback Calculated Property
Cp,gas	865.62	J/mol×K	865.25	Joback Calculated Property
Cp,gas	876.07	J/mol×K	895.63	Joback Calculated Property
Cp,gas	885.75	J/mol×K	926.02	Joback Calculated Property
Cp,gas	894.74	J/mol×K	956.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 1-phenylpropyl ester.

Sources

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

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