Chemical Properties of Glutaric acid, 2,2,3,3-tetrafluoropropyl 1-phenylpropyl ester

InChI

InChI=1S/C17H20F4O4/c1-2-13(12-7-4-3-5-8-12)25-15(23)10-6-9-14(22)24-11-17(20,21)16(18)19/h3-5,7-8,13,16H,2,6,9-11H2,1H3

InChI Key

PUYFJWCXQFOLOW-UHFFFAOYSA-N

Formula

C17H20F4O4

SMILES

CCC(OC(=O)CCCC(=O)OCC(F)(F)C(F)F)c1ccccc1

Molecular Weight¹

364.33

• 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°	-1044.45	kJ/mol	Joback Calculated Property
ΔfH°gas	-1451.03	kJ/mol	Joback Calculated Property
ΔfusH°	37.26	kJ/mol	Joback Calculated Property
ΔvapH°	68.68	kJ/mol	Joback Calculated Property
log10WS	-4.85		Crippen Calculated Property
logPoct/wat	4.295		Crippen Calculated Property
McVol	248.590	ml/mol	McGowan Calculated Property
Pc	1511.67	kPa	Joback Calculated Property
Inp	[1914.00; 1914.00]
Inp	1914.00		NIST
Inp	1914.00		NIST
Tboil	760.59	K	Joback Calculated Property
Tc	949.37	K	Joback Calculated Property
Tfus	426.87	K	Joback Calculated Property
Vc	0.977	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[738.77; 809.79]	J/mol×K	[760.59; 949.37]
Cp,gas	738.77	J/mol×K	760.59	Joback Calculated Property
Cp,gas	752.89	J/mol×K	792.05	Joback Calculated Property
Cp,gas	766.05	J/mol×K	823.52	Joback Calculated Property
Cp,gas	778.29	J/mol×K	854.98	Joback Calculated Property
Cp,gas	789.63	J/mol×K	886.44	Joback Calculated Property
Cp,gas	800.12	J/mol×K	917.90	Joback Calculated Property
Cp,gas	809.79	J/mol×K	949.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl 1-phenylpropyl ester.

Sources

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

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