Chemical Properties of Succinic acid, 2-fluorophenyl cis-pent-2-en-1-yl ester

InChI

InChI=1S/C15H17FO4/c1-2-3-6-11-19-14(17)9-10-15(18)20-13-8-5-4-7-12(13)16/h3-8H,2,9-11H2,1H3/b6-3-

InChI Key

IPBHQNVRPWIWJG-UTCJRWHESA-N

Formula

C15H17FO4

SMILES

CCC=CCOC(=O)CCC(=O)Oc1ccccc1F

Molecular Weight¹

280.29

• 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°	-404.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-696.36	kJ/mol	Joback Calculated Property
ΔfusH°	37.11	kJ/mol	Joback Calculated Property
ΔvapH°	69.38	kJ/mol	Joback Calculated Property
log10WS	-3.76		Crippen Calculated Property
logPoct/wat	3.021		Crippen Calculated Property
McVol	210.800	ml/mol	McGowan Calculated Property
Pc	1987.66	kPa	Joback Calculated Property
Inp	[1955.00; 1955.00]
Inp	1955.00		NIST
Inp	1955.00		NIST
Tboil	730.27	K	Joback Calculated Property
Tc	933.11	K	Joback Calculated Property
Tfus	437.58	K	Joback Calculated Property
Vc	0.814	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[577.49; 646.64]	J/mol×K	[730.27; 933.11]
Cp,gas	577.49	J/mol×K	730.27	Joback Calculated Property
Cp,gas	591.14	J/mol×K	764.08	Joback Calculated Property
Cp,gas	603.91	J/mol×K	797.88	Joback Calculated Property
Cp,gas	615.82	J/mol×K	831.69	Joback Calculated Property
Cp,gas	626.90	J/mol×K	865.50	Joback Calculated Property
Cp,gas	637.17	J/mol×K	899.30	Joback Calculated Property
Cp,gas	646.64	J/mol×K	933.11	Joback Calculated Property

Similar Compounds

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

Sources

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

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