Chemical Properties of Succinic acid, 1,1,1-trifluoroprop-2-yl pent-4-en-2-yl ester

InChI

InChI=1S/C12H17F3O4/c1-4-5-8(2)18-10(16)6-7-11(17)19-9(3)12(13,14)15/h4,8-9H,1,5-7H2,2-3H3

InChI Key

VWGKDENEBJFXMW-UHFFFAOYSA-N

Formula

C12H17F3O4

SMILES

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

Molecular Weight¹

282.26

• 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°	-916.31	kJ/mol	Joback Calculated Property
ΔfH°gas	-1262.82	kJ/mol	Joback Calculated Property
ΔfusH°	25.91	kJ/mol	Joback Calculated Property
ΔvapH°	55.42	kJ/mol	Joback Calculated Property
log10WS	-3.31		Crippen Calculated Property
logPoct/wat	2.768		Crippen Calculated Property
McVol	195.830	ml/mol	McGowan Calculated Property
Pc	1832.54	kPa	Joback Calculated Property
Inp	[1310.00; 1310.00]
Inp	1310.00		NIST
Inp	1310.00		NIST
Tboil	616.92	K	Joback Calculated Property
Tc	790.59	K	Joback Calculated Property
Tfus	341.75	K	Joback Calculated Property
Vc	0.767	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[522.33; 592.62]	J/mol×K	[616.92; 790.59]
Cp,gas	522.33	J/mol×K	616.92	Joback Calculated Property
Cp,gas	535.71	J/mol×K	645.87	Joback Calculated Property
Cp,gas	548.40	J/mol×K	674.81	Joback Calculated Property
Cp,gas	560.42	J/mol×K	703.76	Joback Calculated Property
Cp,gas	571.78	J/mol×K	732.70	Joback Calculated Property
Cp,gas	582.51	J/mol×K	761.65	Joback Calculated Property
Cp,gas	592.62	J/mol×K	790.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 1,1,1-trifluoroprop-2-yl pent-4-en-2-yl ester.

Sources

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

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