Chemical Properties of Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2-methoxy-5-methylphenyl ester

InChI

InChI=1S/C17H16F8O5/c1-9-3-4-10(28-2)11(7-9)30-13(27)6-5-12(26)29-8-15(20,21)17(24,25)16(22,23)14(18)19/h3-4,7,14H,5-6,8H2,1-2H3

InChI Key

KELUEXLJGVBASS-UHFFFAOYSA-N

Formula

C17H16F8O5

SMILES

COc1ccc(C)cc1OC(=O)CCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

452.29

• 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°	-1939.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-2402.85	kJ/mol	Joback Calculated Property
ΔfusH°	38.69	kJ/mol	Joback Calculated Property
ΔvapH°	66.95	kJ/mol	Joback Calculated Property
log10WS	-5.43		Crippen Calculated Property
logPoct/wat	4.403		Crippen Calculated Property
McVol	261.540	ml/mol	McGowan Calculated Property
Pc	1304.23	kPa	Joback Calculated Property
Inp	[2010.00; 2010.00]
Inp	2010.00		NIST
Inp	2010.00		NIST
Tboil	784.03	K	Joback Calculated Property
Tc	967.15	K	Joback Calculated Property
Tfus	496.34	K	Joback Calculated Property
Vc	1.050	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[798.40; 858.85]	J/mol×K	[784.03; 967.15]
Cp,gas	798.40	J/mol×K	784.03	Joback Calculated Property
Cp,gas	810.57	J/mol×K	814.55	Joback Calculated Property
Cp,gas	821.85	J/mol×K	845.07	Joback Calculated Property
Cp,gas	832.28	J/mol×K	875.59	Joback Calculated Property
Cp,gas	841.89	J/mol×K	906.11	Joback Calculated Property
Cp,gas	850.73	J/mol×K	936.63	Joback Calculated Property
Cp,gas	858.85	J/mol×K	967.15	Joback Calculated Property

Similar Compounds

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

Sources

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

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