Chemical Properties of Succinic acid, 2-fluorophenethyl octadecyl ester

InChI

InChI=1S/C30H49FO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-34-29(32)22-23-30(33)35-26-24-27-20-17-18-21-28(27)31/h17-18,20-21H,2-16,19,22-26H2,1H3

InChI Key

UYGPURIULDUAIF-UHFFFAOYSA-N

Formula

C30H49FO4

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)OCCc1ccccc1F

Molecular Weight¹

492.71

• 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	1.3232		Relay (1.0) Calculated Property
ΔfG°	-358.15	kJ/mol	Joback Calculated Property
ΔfH°gas	-1233.32	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	75.76	kJ/mol	Joback Calculated Property
ΔvapH°	144.59	kJ/mol	Relay (1.0) Calculated Property
IE	9.11	eV	Relay (1.0) Calculated Property
log10WS	-8.28		Relay (1.0) Calculated Property
logPoct/wat	8.496		Crippen Calculated Property
McVol	426.450	ml/mol	McGowan Calculated Property
Pc	716.83	kPa	Joback Calculated Property
Inp	[3449.00; 3449.00]
Inp	3449.00		NIST
Inp	3449.00		NIST
Tboil	705.72	K	Relay (1.0) Calculated Property
Tc	890.28	K	Relay (1.0) Calculated Property
Tfus	322.65	K	Relay (1.0) Calculated Property
Vc	1.617	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1503.27; 1588.48]	J/mol×K	[1069.31; 1329.04]
Cp,gas	1503.27	J/mol×K	1069.31	Joback Calculated Property
Cp,gas	1522.55	J/mol×K	1112.60	Joback Calculated Property
Cp,gas	1539.65	J/mol×K	1155.89	Joback Calculated Property
Cp,gas	1554.68	J/mol×K	1199.17	Joback Calculated Property
Cp,gas	1567.76	J/mol×K	1242.46	Joback Calculated Property
Cp,gas	1578.99	J/mol×K	1285.75	Joback Calculated Property
Cp,gas	1588.48	J/mol×K	1329.04	Joback Calculated Property

Similar Compounds

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

Sources

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

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