Chemical Properties of Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl neopentyl ester

InChI

InChI=1S/C14H18F8O4/c1-11(2,3)6-25-8(23)4-5-9(24)26-7-12(17,18)14(21,22)13(19,20)10(15)16/h10H,4-7H2,1-3H3

InChI Key

WYEDCKOWPWMKNR-UHFFFAOYSA-N

Formula

C14H18F8O4

SMILES

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

Molecular Weight¹

402.28

• 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	0.7750		Relay (... Calculated Property
ΔfG°	-1950.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-2542.62	kJ/mol	Relay (... Calculated Property
ΔfusH°	29.05	kJ/mol	Joback Calculated Property
ΔvapH°	75.38	kJ/mol	Relay (... Calculated Property
IE	10.38	eV	Relay (... Calculated Property
log10WS	-5.47		Relay (... Calculated Property
logPoct/wat	4.070		Crippen Calculated Property
McVol	237.160	ml/mol	McGowan Calculated Property
Pc	1326.17	kPa	Joback Calculated Property
Inp	[1460.00; 1460.00]
Inp	1460.00		NIST
Inp	1460.00		NIST
Tboil	533.87	K	Relay (... Calculated Property
Tc	669.52	K	Relay (... Calculated Property
Tfus	328.88	K	Relay (... Calculated Property
Vc	0.917	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[696.88; 766.39]	J/mol×K	[653.10; 814.67]
Cp,gas	696.88	J/mol×K	653.10	Joback Calculated Property
Cp,gas	710.38	J/mol×K	680.03	Joback Calculated Property
Cp,gas	723.05	J/mol×K	706.96	Joback Calculated Property
Cp,gas	734.95	J/mol×K	733.88	Joback Calculated Property
Cp,gas	746.11	J/mol×K	760.81	Joback Calculated Property
Cp,gas	756.58	J/mol×K	787.74	Joback Calculated Property
Cp,gas	766.39	J/mol×K	814.67	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl neopentyl ester.

Sources

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

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