Chemical Properties of Glutaric acid, 3,5-dimethylcyclohexyl 2,2,3,3-tetrafluoropropyl ester

InChI

InChI=1S/C16H24F4O4/c1-10-6-11(2)8-12(7-10)24-14(22)5-3-4-13(21)23-9-16(19,20)15(17)18/h10-12,15H,3-9H2,1-2H3

InChI Key

AWBIDUXXHIVNEX-UHFFFAOYSA-N

Formula

C16H24F4O4

SMILES

CC1CC(C)CC(OC(=O)CCCC(=O)OCC(F)(F)C(F)F)C1

Molecular Weight¹

356.35

• 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°	-1153.81	kJ/mol	Joback Calculated Property
ΔfH°gas	-1648.00	kJ/mol	Joback Calculated Property
ΔfusH°	38.13	kJ/mol	Joback Calculated Property
ΔvapH°	64.38	kJ/mol	Joback Calculated Property
log10WS	-4.40		Crippen Calculated Property
logPoct/wat	3.968		Crippen Calculated Property
McVol	247.400	ml/mol	McGowan Calculated Property
Pc	1396.46	kPa	Joback Calculated Property
Inp	[1781.00; 1781.00]
Inp	1781.00		NIST
Inp	1781.00		NIST
Tboil	721.68	K	Joback Calculated Property
Tc	903.70	K	Joback Calculated Property
Tfus	403.08	K	Joback Calculated Property
Vc	0.966	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[767.03; 855.93]	J/mol×K	[721.68; 903.70]
Cp,gas	767.03	J/mol×K	721.68	Joback Calculated Property
Cp,gas	784.44	J/mol×K	752.02	Joback Calculated Property
Cp,gas	800.79	J/mol×K	782.35	Joback Calculated Property
Cp,gas	816.10	J/mol×K	812.69	Joback Calculated Property
Cp,gas	830.38	J/mol×K	843.03	Joback Calculated Property
Cp,gas	843.65	J/mol×K	873.37	Joback Calculated Property
Cp,gas	855.93	J/mol×K	903.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3,5-dimethylcyclohexyl 2,2,3,3-tetrafluoropropyl ester.

Sources

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

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