Chemical Properties of Glutaric acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl ester

InChI

InChI=1S/C17H25F7O4/c1-2-3-4-5-6-7-11-27-13(25)9-8-10-14(26)28-12-15(18,19)16(20,21)17(22,23)24/h2-12H2,1H3

InChI Key

SDFLHZQHOPCPQH-UHFFFAOYSA-N

Formula

C17H25F7O4

SMILES

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

Molecular Weight¹

426.37

• 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°	-1730.73	kJ/mol	Joback Calculated Property
ΔfH°gas	-2282.83	kJ/mol	Joback Calculated Property
ΔfusH°	44.68	kJ/mol	Joback Calculated Property
ΔvapH°	62.14	kJ/mol	Joback Calculated Property
log10WS	-5.95		Crippen Calculated Property
logPoct/wat	5.437		Crippen Calculated Property
McVol	277.660	ml/mol	McGowan Calculated Property
Pc	1099.35	kPa	Joback Calculated Property
Inp	[1942.00; 1942.00]
Inp	1942.00		NIST
Inp	1942.00		NIST
Tboil	726.14	K	Joback Calculated Property
Tc	892.08	K	Joback Calculated Property
Tfus	437.06	K	Joback Calculated Property
Vc	1.129	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[850.72; 928.00]	J/mol×K	[726.14; 892.08]
Cp,gas	850.72	J/mol×K	726.14	Joback Calculated Property
Cp,gas	865.58	J/mol×K	753.80	Joback Calculated Property
Cp,gas	879.59	J/mol×K	781.45	Joback Calculated Property
Cp,gas	892.80	J/mol×K	809.11	Joback Calculated Property
Cp,gas	905.24	J/mol×K	836.77	Joback Calculated Property
Cp,gas	916.97	J/mol×K	864.42	Joback Calculated Property
Cp,gas	928.00	J/mol×K	892.08	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3,4,4,4-heptafluorobutyl octyl ester.

Sources

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

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