Chemical Properties of Succinic acid, 2-fluorophenyl neopentyl ester

InChI

InChI=1S/C15H19FO4/c1-15(2,3)10-19-13(17)8-9-14(18)20-12-7-5-4-6-11(12)16/h4-7H,8-10H2,1-3H3

InChI Key

GPANKRLKKJTRFW-UHFFFAOYSA-N

Formula

C15H19FO4

SMILES

CC(C)(C)COC(=O)CCC(=O)Oc1ccccc1F

Molecular Weight¹

282.31

• 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	0.7276		Relay (... Calculated Property
ΔfG°	-481.61	kJ/mol	Joback Calculated Property
ΔfH°gas	-943.21	kJ/mol	Relay (... Calculated Property
ΔfusH°	29.50	kJ/mol	Joback Calculated Property
ΔvapH°	81.03	kJ/mol	Relay (... Calculated Property
IE	8.84	eV	Relay (... Calculated Property
log10WS	-4.03		Relay (... Calculated Property
logPoct/wat	3.101		Crippen Calculated Property
McVol	215.100	ml/mol	McGowan Calculated Property
Pc	1930.44	kPa	Joback Calculated Property
Inp	[1828.00; 1828.00]
Inp	1828.00		NIST
Inp	1828.00		NIST
Tboil	568.80	K	Relay (... Calculated Property
Tc	771.58	K	Relay (... Calculated Property
Tfus	351.59	K	Relay (... Calculated Property
Vc	0.798	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[603.88; 677.01]	J/mol×K	[722.88; 928.08]
Cp,gas	603.88	J/mol×K	722.88	Joback Calculated Property
Cp,gas	618.42	J/mol×K	757.08	Joback Calculated Property
Cp,gas	631.98	J/mol×K	791.28	Joback Calculated Property
Cp,gas	644.59	J/mol×K	825.48	Joback Calculated Property
Cp,gas	656.28	J/mol×K	859.68	Joback Calculated Property
Cp,gas	667.08	J/mol×K	893.88	Joback Calculated Property
Cp,gas	677.01	J/mol×K	928.08	Joback Calculated Property

Similar Compounds

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

Sources

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

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