Chemical Properties of Hexyl perfluoropentanoate

InChI

InChI=1S/C11H13F9O2/c1-2-3-4-5-6-22-7(21)8(12,13)9(14,15)10(16,17)11(18,19)20/h2-6H2,1H3

InChI Key

FALKAIRAHKEYPI-UHFFFAOYSA-N

Formula

C11H13F9O2

SMILES

CCCCCCOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

348.21

Other Names

• 2,2,3,3,4,4,5,5,5-Nonafluoro-pentanoic acid hexyl ester

• 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°	-1934.11	kJ/mol	Joback Calculated Property
ΔfH°gas	-2315.16	kJ/mol	Joback Calculated Property
ΔfusH°	25.10	kJ/mol	Joback Calculated Property
ΔvapH°	36.70	kJ/mol	Joback Calculated Property
log10WS	-4.89		Crippen Calculated Property
logPoct/wat	4.578		Crippen Calculated Property
McVol	189.220	ml/mol	McGowan Calculated Property
Pc	1529.46	kPa	Joback Calculated Property
Inp	[976.90; 977.00]
Inp	977.00		NIST
Inp	976.90		NIST
Tboil	507.88	K	Joback Calculated Property
Tc	651.30	K	Joback Calculated Property
Tfus	300.88	K	Joback Calculated Property
Vc	0.793	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[500.04; 569.25]	J/mol×K	[507.88; 651.30]
Cp,gas	500.04	J/mol×K	507.88	Joback Calculated Property
Cp,gas	513.33	J/mol×K	531.78	Joback Calculated Property
Cp,gas	525.87	J/mol×K	555.69	Joback Calculated Property
Cp,gas	537.71	J/mol×K	579.59	Joback Calculated Property
Cp,gas	548.86	J/mol×K	603.50	Joback Calculated Property
Cp,gas	559.36	J/mol×K	627.40	Joback Calculated Property
Cp,gas	569.25	J/mol×K	651.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hexyl perfluoropentanoate.

Sources

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

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