Chemical Properties of Succinic acid, 3-chlorophenyl 2,2,3,3,3-pentafluoropropyl ester

InChI

InChI=1S/C13H10ClF5O4/c14-8-2-1-3-9(6-8)23-11(21)5-4-10(20)22-7-12(15,16)13(17,18)19/h1-3,6H,4-5,7H2

InChI Key

IFVNNPJCJUPTFP-UHFFFAOYSA-N

Formula

C13H10ClF5O4

SMILES

O=C(CCC(=O)Oc1cccc(Cl)c1)OCC(F)(F)C(F)(F)F

Molecular Weight¹

360.66

• 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°	-1286.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-1589.98	kJ/mol	Joback Calculated Property
ΔfusH°	33.42	kJ/mol	Joback Calculated Property
ΔvapH°	63.49	kJ/mol	Joback Calculated Property
log10WS	-4.40		Crippen Calculated Property
logPoct/wat	3.766		Crippen Calculated Property
McVol	206.240	ml/mol	McGowan Calculated Property
Pc	1920.30	kPa	Joback Calculated Property
Inp	[1678.00; 1678.00]
Inp	1678.00		NIST
Inp	1678.00		NIST
Tboil	708.40	K	Joback Calculated Property
Tc	901.23	K	Joback Calculated Property
Tfus	457.24	K	Joback Calculated Property
Vc	0.821	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[558.24; 611.81]	J/mol×K	[708.40; 901.23]
Cp,gas	558.24	J/mol×K	708.40	Joback Calculated Property
Cp,gas	569.09	J/mol×K	740.54	Joback Calculated Property
Cp,gas	579.11	J/mol×K	772.68	Joback Calculated Property
Cp,gas	588.35	J/mol×K	804.81	Joback Calculated Property
Cp,gas	596.86	J/mol×K	836.95	Joback Calculated Property
Cp,gas	604.66	J/mol×K	869.09	Joback Calculated Property
Cp,gas	611.81	J/mol×K	901.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-chlorophenyl 2,2,3,3,3-pentafluoropropyl ester.

Sources

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

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