Chemical Properties of Succinic acid, 2-fluorophenyl 2,4-dimethylpent-3-yl ester

InChI

InChI=1S/C17H23FO4/c1-11(2)17(12(3)4)22-16(20)10-9-15(19)21-14-8-6-5-7-13(14)18/h5-8,11-12,17H,9-10H2,1-4H3

InChI Key

PRRGJKHCVOAJGJ-UHFFFAOYSA-N

Formula

C17H23FO4

SMILES

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

Molecular Weight¹

310.36

• 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°	-474.93	kJ/mol	Joback Calculated Property
ΔfH°gas	-870.70	kJ/mol	Joback Calculated Property
ΔfusH°	31.52	kJ/mol	Joback Calculated Property
ΔvapH°	72.70	kJ/mol	Joback Calculated Property
log10WS	-4.38		Crippen Calculated Property
logPoct/wat	3.735		Crippen Calculated Property
McVol	243.280	ml/mol	McGowan Calculated Property
Pc	1648.43	kPa	Joback Calculated Property
Inp	[2008.00; 2008.00]
Inp	2008.00		NIST
Inp	2008.00		NIST
Tboil	770.55	K	Joback Calculated Property
Tc	972.72	K	Joback Calculated Property
Tfus	420.20	K	Joback Calculated Property
Vc	0.927	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[713.62; 790.89]	J/mol×K	[770.55; 972.72]
Cp,gas	713.62	J/mol×K	770.55	Joback Calculated Property
Cp,gas	729.10	J/mol×K	804.25	Joback Calculated Property
Cp,gas	743.52	J/mol×K	837.94	Joback Calculated Property
Cp,gas	756.89	J/mol×K	871.64	Joback Calculated Property
Cp,gas	769.23	J/mol×K	905.33	Joback Calculated Property
Cp,gas	780.56	J/mol×K	939.03	Joback Calculated Property
Cp,gas	790.89	J/mol×K	972.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-fluorophenyl 2,4-dimethylpent-3-yl ester.

Sources

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

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