Chemical Properties of Succinic acid, 2-fluorophenyl hex-5-en-1-yl ester

InChI

InChI=1S/C16H19FO4/c1-2-3-4-7-12-20-15(18)10-11-16(19)21-14-9-6-5-8-13(14)17/h2,5-6,8-9H,1,3-4,7,10-12H2

InChI Key

XDQGNEFVRLPKDZ-UHFFFAOYSA-N

Formula

C16H19FO4

SMILES

C=CCCCCOC(=O)CCC(=O)Oc1ccccc1F

Molecular Weight¹

294.32

• 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°	-388.19	kJ/mol	Joback Calculated Property
ΔfH°gas	-708.79	kJ/mol	Joback Calculated Property
ΔfusH°	38.22	kJ/mol	Joback Calculated Property
ΔvapH°	70.97	kJ/mol	Joback Calculated Property
log10WS	-4.18		Crippen Calculated Property
logPoct/wat	3.411		Crippen Calculated Property
McVol	224.890	ml/mol	McGowan Calculated Property
Pc	1812.32	kPa	Joback Calculated Property
Inp	[2069.00; 2069.00]
Inp	2069.00		NIST
Inp	2069.00		NIST
Tboil	745.67	K	Joback Calculated Property
Tc	943.52	K	Joback Calculated Property
Tfus	452.17	K	Joback Calculated Property
Vc	0.871	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[631.21; 702.15]	J/mol×K	[745.67; 943.52]
Cp,gas	631.21	J/mol×K	745.67	Joback Calculated Property
Cp,gas	645.23	J/mol×K	778.65	Joback Calculated Property
Cp,gas	658.36	J/mol×K	811.62	Joback Calculated Property
Cp,gas	670.60	J/mol×K	844.60	Joback Calculated Property
Cp,gas	681.96	J/mol×K	877.57	Joback Calculated Property
Cp,gas	692.47	J/mol×K	910.55	Joback Calculated Property
Cp,gas	702.15	J/mol×K	943.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl hex-5-en-1-yl ester.

Sources

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

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