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

InChI

InChI=1S/C24H34F4O4/c1-2-3-4-5-6-7-8-9-10-11-15-31-20(29)13-12-14-21(30)32-17-18-16-19(25)23(27)24(28)22(18)26/h16H,2-15,17H2,1H3

InChI Key

OBQKIVJKUMYSEO-UHFFFAOYSA-N

Formula

C24H34F4O4

SMILES

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

Molecular Weight¹

462.52

• 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°	-1021.99	kJ/mol	Joback Calculated Property
ΔfH°gas	-1622.08	kJ/mol	Joback Calculated Property
ΔfusH°	68.30	kJ/mol	Joback Calculated Property
ΔvapH°	88.99	kJ/mol	Joback Calculated Property
log10WS	-8.52		Crippen Calculated Property
logPoct/wat	6.921		Crippen Calculated Property
McVol	347.220	ml/mol	McGowan Calculated Property
Pc	896.95	kPa	Joback Calculated Property
Inp	[2852.00; 2852.00]
Inp	2852.00		NIST
Inp	2852.00		NIST
Tboil	944.78	K	Joback Calculated Property
Tc	1160.06	K	Joback Calculated Property
Tfus	583.42	K	Joback Calculated Property
Vc	1.391	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1145.50; 1222.41]	J/mol×K	[944.78; 1160.06]
Cp,gas	1145.50	J/mol×K	944.78	Joback Calculated Property
Cp,gas	1161.91	J/mol×K	980.66	Joback Calculated Property
Cp,gas	1176.85	J/mol×K	1016.54	Joback Calculated Property
Cp,gas	1190.34	J/mol×K	1052.42	Joback Calculated Property
Cp,gas	1202.42	J/mol×K	1088.30	Joback Calculated Property
Cp,gas	1213.10	J/mol×K	1124.18	Joback Calculated Property
Cp,gas	1222.41	J/mol×K	1160.06	Joback Calculated Property

Similar Compounds

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

Sources

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

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