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

InChI

InChI=1S/C14H18F8O4/c1-8(2)5-6-25-9(23)3-4-10(24)26-7-12(17,18)14(21,22)13(19,20)11(15)16/h8,11H,3-7H2,1-2H3

InChI Key

AXTWWOICHONWOA-UHFFFAOYSA-N

Formula

C14H18F8O4

SMILES

CC(C)CCOC(=O)CCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

402.28

• 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	0.7924		Relay (... Calculated Property
ΔfG°	-1955.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-2525.69	kJ/mol	Relay (... Calculated Property
ΔfusH°	32.94	kJ/mol	Joback Calculated Property
ΔvapH°	77.76	kJ/mol	Relay (... Calculated Property
IE	10.31	eV	Relay (... Calculated Property
log10WS	-5.28		Relay (... Calculated Property
logPoct/wat	4.070		Crippen Calculated Property
McVol	237.160	ml/mol	McGowan Calculated Property
Pc	1315.61	kPa	Joback Calculated Property
Inp	[1512.00; 1512.00]
Inp	1512.00		NIST
Inp	1512.00		NIST
Tboil	535.59	K	Relay (... Calculated Property
Tc	671.30	K	Relay (... Calculated Property
Tfus	279.17	K	Relay (... Calculated Property
Vc	0.901	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[694.55; 764.27]	J/mol×K	[655.89; 814.74]
Cp,gas	694.55	J/mol×K	655.89	Joback Calculated Property
Cp,gas	707.97	J/mol×K	682.36	Joback Calculated Property
Cp,gas	720.63	J/mol×K	708.84	Joback Calculated Property
Cp,gas	732.55	J/mol×K	735.31	Joback Calculated Property
Cp,gas	743.78	J/mol×K	761.79	Joback Calculated Property
Cp,gas	754.34	J/mol×K	788.26	Joback Calculated Property
Cp,gas	764.27	J/mol×K	814.74	Joback Calculated Property

Similar Compounds

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

Sources

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

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