Chemical Properties of Succinic acid, 2-fluorophenethyl hexyl ester

InChI

InChI=1S/C18H25FO4/c1-2-3-4-7-13-22-17(20)10-11-18(21)23-14-12-15-8-5-6-9-16(15)19/h5-6,8-9H,2-4,7,10-14H2,1H3

InChI Key

GZPNVOZQQWKBFO-UHFFFAOYSA-N

Formula

C18H25FO4

SMILES

CCCCCCOC(=O)CCC(=O)OCCc1ccccc1F

Molecular Weight¹

324.39

• 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).
• 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
ΔfG°	-459.19	kJ/mol	Joback Calculated Property
ΔfH°gas	-875.50	kJ/mol	Joback Calculated Property
ΔfusH°	44.68	kJ/mol	Joback Calculated Property
ΔvapH°	76.09	kJ/mol	Joback Calculated Property
log10WS	-4.52		Crippen Calculated Property
logPoct/wat	3.815		Crippen Calculated Property
McVol	257.370	ml/mol	McGowan Calculated Property
Pc	1498.83	kPa	Joback Calculated Property
Inp	[2236.00; 2236.00]
Inp	2236.00		NIST
Inp	2236.00		NIST
Tboil	794.75	K	Joback Calculated Property
Tc	989.35	K	Joback Calculated Property
Tfus	476.47	K	Joback Calculated Property
Vc	1.002	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[768.80; 845.31]	J/mol×K	[794.75; 989.35]
Cp,gas	768.80	J/mol×K	794.75	Joback Calculated Property
Cp,gas	783.99	J/mol×K	827.18	Joback Calculated Property
Cp,gas	798.18	J/mol×K	859.62	Joback Calculated Property
Cp,gas	811.39	J/mol×K	892.05	Joback Calculated Property
Cp,gas	823.64	J/mol×K	924.48	Joback Calculated Property
Cp,gas	834.94	J/mol×K	956.92	Joback Calculated Property
Cp,gas	845.31	J/mol×K	989.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenethyl hexyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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