Chemical Properties of Succinic acid, 2,3-dichlorophenyl 2,2,3,4,4,4-hexafluorobutyl ester

InChI

InChI=1S/C14H10Cl2F6O4/c15-7-2-1-3-8(11(7)16)26-10(24)5-4-9(23)25-6-13(18,19)12(17)14(20,21)22/h1-3,12H,4-6H2

InChI Key

FWPCWKXYQINLLY-UHFFFAOYSA-N

Formula

C14H10Cl2F6O4

SMILES

O=C(CCC(=O)Oc1cccc(Cl)c1Cl)OCC(F)(F)C(F)C(F)(F)F

Molecular Weight¹

427.12

• 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	0.8027		Relay (1.0) Calculated Property
ΔfG°	-1497.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-1969.04	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.38	kJ/mol	Joback Calculated Property
ΔvapH°	89.39	kJ/mol	Relay (1.0) Calculated Property
IE	9.31	eV	Relay (1.0) Calculated Property
log10WS	-5.86		Relay (1.0) Calculated Property
logPoct/wat	4.758		Crippen Calculated Property
McVol	234.340	ml/mol	McGowan Calculated Property
Pc	1643.09	kPa	Joback Calculated Property
Inp	[2015.00; 2015.00]
Inp	2015.00		NIST
Inp	2015.00		NIST
Tboil	585.06	K	Relay (1.0) Calculated Property
Tc	785.22	K	Relay (1.0) Calculated Property
Tfus	313.49	K	Relay (1.0) Calculated Property
Vc	0.845	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[640.28; 688.50]	J/mol×K	[772.52; 966.17]
Cp,gas	640.28	J/mol×K	772.52	Joback Calculated Property
Cp,gas	650.18	J/mol×K	804.80	Joback Calculated Property
Cp,gas	659.28	J/mol×K	837.07	Joback Calculated Property
Cp,gas	667.62	J/mol×K	869.35	Joback Calculated Property
Cp,gas	675.24	J/mol×K	901.62	Joback Calculated Property
Cp,gas	682.19	J/mol×K	933.90	Joback Calculated Property
Cp,gas	688.50	J/mol×K	966.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,3-dichlorophenyl 2,2,3,4,4,4-hexafluorobutyl ester.

Sources

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

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