Chemical Properties of Glutaric acid, 8-chlorooctyl 2,2,3,3,3-pentafluoropropyl ester

InChI

InChI=1S/C16H24ClF5O4/c17-10-5-3-1-2-4-6-11-25-13(23)8-7-9-14(24)26-12-15(18,19)16(20,21)22/h1-12H2

InChI Key

ANKTVYCEBQSQOI-UHFFFAOYSA-N

Formula

C16H24ClF5O4

SMILES

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

Molecular Weight¹

410.80

• 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°	-1364.30	kJ/mol	Joback Calculated Property
ΔfH°gas	-1876.96	kJ/mol	Joback Calculated Property
ΔfusH°	47.54	kJ/mol	Joback Calculated Property
ΔvapH°	67.23	kJ/mol	Joback Calculated Property
log10WS	-5.37		Crippen Calculated Property
logPoct/wat	5.020		Crippen Calculated Property
McVol	272.270	ml/mol	McGowan Calculated Property
Pc	1200.62	kPa	Joback Calculated Property
Inp	[1973.00; 1973.00]
Inp	1973.00		NIST
Inp	1973.00		NIST
Tboil	745.38	K	Joback Calculated Property
Tc	917.55	K	Joback Calculated Property
Tfus	452.11	K	Joback Calculated Property
Vc	1.097	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[807.07; 880.11]	J/mol×K	[745.38; 917.55]
Cp,gas	807.07	J/mol×K	745.38	Joback Calculated Property
Cp,gas	821.17	J/mol×K	774.08	Joback Calculated Property
Cp,gas	834.45	J/mol×K	802.77	Joback Calculated Property
Cp,gas	846.95	J/mol×K	831.47	Joback Calculated Property
Cp,gas	858.71	J/mol×K	860.16	Joback Calculated Property
Cp,gas	869.75	J/mol×K	888.86	Joback Calculated Property
Cp,gas	880.11	J/mol×K	917.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 8-chlorooctyl 2,2,3,3,3-pentafluoropropyl ester.

Sources

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

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