Chemical Properties of Glutaric acid, 1,1,1-trifluoroprop-2-yl 10-chlorodecyl ester

InChI

InChI=1S/C18H30ClF3O4/c1-15(18(20,21)22)26-17(24)12-10-11-16(23)25-14-9-7-5-3-2-4-6-8-13-19/h15H,2-14H2,1H3

InChI Key

WPKKENRNGBUKIU-UHFFFAOYSA-N

Formula

C18H30ClF3O4

SMILES

CC(OC(=O)CCCC(=O)OCCCCCCCCCCCl)C(F)(F)F

Molecular Weight¹

402.88

• 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°	-963.12	kJ/mol	Joback Calculated Property
ΔfH°gas	-1522.55	kJ/mol	Joback Calculated Property
ΔfusH°	50.45	kJ/mol	Joback Calculated Property
ΔvapH°	74.22	kJ/mol	Joback Calculated Property
log10WS	-6.01		Crippen Calculated Property
logPoct/wat	5.554		Crippen Calculated Property
McVol	296.910	ml/mol	McGowan Calculated Property
Pc	1111.85	kPa	Joback Calculated Property
Inp	[2242.00; 2242.00]
Inp	2242.00		NIST
Inp	2242.00		NIST
Tboil	795.39	K	Joback Calculated Property
Tc	976.33	K	Joback Calculated Property
Tfus	456.05	K	Joback Calculated Property
Vc	1.177	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[905.39; 986.17]	J/mol×K	[795.39; 976.33]
Cp,gas	905.39	J/mol×K	795.39	Joback Calculated Property
Cp,gas	921.10	J/mol×K	825.55	Joback Calculated Property
Cp,gas	935.86	J/mol×K	855.70	Joback Calculated Property
Cp,gas	949.73	J/mol×K	885.86	Joback Calculated Property
Cp,gas	962.71	J/mol×K	916.02	Joback Calculated Property
Cp,gas	974.85	J/mol×K	946.17	Joback Calculated Property
Cp,gas	986.17	J/mol×K	976.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 1,1,1-trifluoroprop-2-yl 10-chlorodecyl ester.

Sources

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

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