Chemical Properties of Succinic acid, 2,2,3,3-tetrafluoropropyl neopentyl ester

InChI

InChI=1S/C12H18F4O4/c1-11(2,3)6-19-8(17)4-5-9(18)20-7-12(15,16)10(13)14/h10H,4-7H2,1-3H3

InChI Key

HNPBHJQTRCOOMW-UHFFFAOYSA-N

Formula

C12H18F4O4

SMILES

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

Molecular Weight¹

302.26

• 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	0.7060		Relay (1.0) Calculated Property
ΔfG°	-1193.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-1719.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	26.38	kJ/mol	Joback Calculated Property
ΔvapH°	68.84	kJ/mol	Relay (1.0) Calculated Property
IE	10.57	eV	Relay (1.0) Calculated Property
log10WS	-3.67		Relay (1.0) Calculated Property
logPoct/wat	2.800		Crippen Calculated Property
McVol	201.900	ml/mol	McGowan Calculated Property
Pc	1718.88	kPa	Joback Calculated Property
Inp	[1359.00; 1359.00]
Inp	1359.00		NIST
Inp	1359.00		NIST
Tboil	513.54	K	Relay (1.0) Calculated Property
Tc	665.91	K	Relay (1.0) Calculated Property
Tfus	335.59	K	Relay (1.0) Calculated Property
Vc	0.770	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[554.66; 626.07]	J/mol×K	[616.72; 786.51]
Cp,gas	554.66	J/mol×K	616.72	Joback Calculated Property
Cp,gas	568.30	J/mol×K	645.02	Joback Calculated Property
Cp,gas	581.21	J/mol×K	673.32	Joback Calculated Property
Cp,gas	593.42	J/mol×K	701.62	Joback Calculated Property
Cp,gas	604.96	J/mol×K	729.92	Joback Calculated Property
Cp,gas	615.83	J/mol×K	758.22	Joback Calculated Property
Cp,gas	626.07	J/mol×K	786.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3-tetrafluoropropyl neopentyl ester.

Sources

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

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