Chemical Properties of Succinic acid, 2,2,3,3-tetrafluoropropyl (2-chlorocyclohexyl)methyl ester

InChI

InChI=1S/C14H19ClF4O4/c15-10-4-2-1-3-9(10)7-22-11(20)5-6-12(21)23-8-14(18,19)13(16)17/h9-10,13H,1-8H2

InChI Key

LBHWWXBISSCPSI-UHFFFAOYSA-N

Formula

C14H19ClF4O4

SMILES

O=C(CCC(=O)OCC(F)(F)C(F)F)OCC1CCCCC1Cl

Molecular Weight¹

362.75

• 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	0.7200		Relay (1.0) Calculated Property
ΔfG°	-1174.87	kJ/mol	Joback Calculated Property
ΔfH°gas	-1695.70	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	36.08	kJ/mol	Joback Calculated Property
ΔvapH°	87.94	kJ/mol	Relay (1.0) Calculated Property
IE	10.18	eV	Relay (1.0) Calculated Property
log10WS	-4.45		Relay (1.0) Calculated Property
logPoct/wat	3.551		Crippen Calculated Property
McVol	231.460	ml/mol	McGowan Calculated Property
Pc	1615.47	kPa	Joback Calculated Property
Inp	[1967.00; 1967.00]
Inp	1967.00		NIST
Inp	1967.00		NIST
Tboil	600.69	K	Relay (1.0) Calculated Property
Tc	775.95	K	Relay (1.0) Calculated Property
Tfus	332.93	K	Relay (1.0) Calculated Property
Vc	0.846	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[683.05; 760.52]	J/mol×K	[718.02; 905.66]
Cp,gas	683.05	J/mol×K	718.02	Joback Calculated Property
Cp,gas	698.41	J/mol×K	749.29	Joback Calculated Property
Cp,gas	712.76	J/mol×K	780.57	Joback Calculated Property
Cp,gas	726.12	J/mol×K	811.84	Joback Calculated Property
Cp,gas	738.53	J/mol×K	843.11	Joback Calculated Property
Cp,gas	749.99	J/mol×K	874.39	Joback Calculated Property
Cp,gas	760.52	J/mol×K	905.66	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3-tetrafluoropropyl (2-chlorocyclohexyl)methyl ester.

Sources

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

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