Chemical Properties of Glutaric acid, (2-chlorocyclohexyl)methyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI

InChI=1S/C17H21ClF8O4/c18-11-5-2-1-4-10(11)8-29-12(27)6-3-7-13(28)30-9-15(21,22)17(25,26)16(23,24)14(19)20/h10-11,14H,1-9H2

InChI Key

SNMKZQDBSIBTRX-UHFFFAOYSA-N

Formula

C17H21ClF8O4

SMILES

O=C(CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)OCC1CCCCC1Cl

Molecular Weight¹

476.79

• 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°	-1923.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-2465.98	kJ/mol	Joback Calculated Property
ΔfusH°	41.34	kJ/mol	Joback Calculated Property
ΔvapH°	65.44	kJ/mol	Joback Calculated Property
log10WS	-5.84		Crippen Calculated Property
logPoct/wat	5.212		Crippen Calculated Property
McVol	280.810	ml/mol	McGowan Calculated Property
Pc	1174.44	kPa	Joback Calculated Property
Inp	[2107.00; 2107.00]
Inp	2107.00		NIST
Inp	2107.00		NIST
Tboil	777.28	K	Joback Calculated Property
Tc	958.79	K	Joback Calculated Property
Tfus	455.71	K	Joback Calculated Property
Vc	1.121	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[886.75; 960.56]	J/mol×K	[777.28; 958.79]
Cp,gas	886.75	J/mol×K	777.28	Joback Calculated Property
Cp,gas	901.52	J/mol×K	807.53	Joback Calculated Property
Cp,gas	915.23	J/mol×K	837.78	Joback Calculated Property
Cp,gas	927.94	J/mol×K	868.03	Joback Calculated Property
Cp,gas	939.70	J/mol×K	898.28	Joback Calculated Property
Cp,gas	950.55	J/mol×K	928.54	Joback Calculated Property
Cp,gas	960.56	J/mol×K	958.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, (2-chlorocyclohexyl)methyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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

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