Chemical Properties of Glutaric acid, 2,3,4,5-tetrafluorobenzyl undecyl ester

InChI

InChI=1S/C23H32F4O4/c1-2-3-4-5-6-7-8-9-10-14-30-19(28)12-11-13-20(29)31-16-17-15-18(24)22(26)23(27)21(17)25/h15H,2-14,16H2,1H3

InChI Key

FDEYGPPJPMFYED-UHFFFAOYSA-N

Formula

C23H32F4O4

SMILES

CCCCCCCCCCCOC(=O)CCCC(=O)OCc1cc(F)c(F)c(F)c1F

Molecular Weight¹

448.49

• 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°	-1030.41	kJ/mol	Joback Calculated Property
ΔfH°gas	-1601.44	kJ/mol	Joback Calculated Property
ΔfusH°	65.70	kJ/mol	Joback Calculated Property
ΔvapH°	86.76	kJ/mol	Joback Calculated Property
log10WS	-8.10		Crippen Calculated Property
logPoct/wat	6.530		Crippen Calculated Property
McVol	333.130	ml/mol	McGowan Calculated Property
Pc	950.84	kPa	Joback Calculated Property
Inp	[2748.00; 2748.00]
Inp	2748.00		NIST
Inp	2748.00		NIST
Tboil	921.90	K	Joback Calculated Property
Tc	1129.90	K	Joback Calculated Property
Tfus	572.15	K	Joback Calculated Property
Vc	1.335	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1084.50; 1160.53]	J/mol×K	[921.90; 1129.90]
Cp,gas	1084.50	J/mol×K	921.90	Joback Calculated Property
Cp,gas	1100.45	J/mol×K	956.57	Joback Calculated Property
Cp,gas	1115.07	J/mol×K	991.23	Joback Calculated Property
Cp,gas	1128.36	J/mol×K	1025.90	Joback Calculated Property
Cp,gas	1140.36	J/mol×K	1060.57	Joback Calculated Property
Cp,gas	1151.07	J/mol×K	1095.23	Joback Calculated Property
Cp,gas	1160.53	J/mol×K	1129.90	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,3,4,5-tetrafluorobenzyl undecyl ester.

Sources

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

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