Chemical Properties of Succinic acid, 3-methylbut-2-en-1-yl 2,2,3,3,3-pentafluoropropyl ester

InChI

InChI=1S/C12H15F5O4/c1-8(2)5-6-20-9(18)3-4-10(19)21-7-11(13,14)12(15,16)17/h5H,3-4,6-7H2,1-2H3

InChI Key

WVOSARPQJOXUNG-UHFFFAOYSA-N

Formula

C12H15F5O4

SMILES

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

Molecular Weight¹

318.24

• 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	0.6549		Relay (1.0) Calculated Property
ΔfG°	-1314.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-1847.06	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	31.87	kJ/mol	Joback Calculated Property
ΔvapH°	70.27	kJ/mol	Relay (1.0) Calculated Property
IE	9.43	eV	Relay (1.0) Calculated Property
log10WS	-4.02		Relay (1.0) Calculated Property
logPoct/wat	3.017		Crippen Calculated Property
McVol	199.370	ml/mol	McGowan Calculated Property
Pc	1724.59	kPa	Joback Calculated Property
Inp	[1362.00; 1362.00]
Inp	1362.00		NIST
Inp	1362.00		NIST
Tboil	499.71	K	Relay (1.0) Calculated Property
Tc	623.25	K	Relay (1.0) Calculated Property
Tfus	266.13	K	Relay (1.0) Calculated Property
Vc	0.726	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[541.39; 606.66]	J/mol×K	[620.47; 789.43]
Cp,gas	541.39	J/mol×K	620.47	Joback Calculated Property
Cp,gas	553.92	J/mol×K	648.63	Joback Calculated Property
Cp,gas	565.76	J/mol×K	676.79	Joback Calculated Property
Cp,gas	576.92	J/mol×K	704.95	Joback Calculated Property
Cp,gas	587.43	J/mol×K	733.11	Joback Calculated Property
Cp,gas	597.34	J/mol×K	761.27	Joback Calculated Property
Cp,gas	606.66	J/mol×K	789.43	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-methylbut-2-en-1-yl 2,2,3,3,3-pentafluoropropyl ester.

Sources

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

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