Chemical Properties of Heptadecafluorononanoic acid, tetradecyl ester

InChI

InChI=1S/C23H29F17O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-42-15(41)16(24,25)17(26,27)18(28,29)19(30,31)20(32,33)21(34,35)22(36,37)23(38,39)40/h2-14H2,1H3

InChI Key

CPKCTWGWQFCVSL-UHFFFAOYSA-N

Formula

C23H29F17O2

SMILES

CCCCCCCCCCCCCCOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

660.45

• 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°	-3380.19	kJ/mol	Joback Calculated Property
ΔfH°gas	-4166.72	kJ/mol	Joback Calculated Property
ΔfusH°	51.16	kJ/mol	Joback Calculated Property
ΔvapH°	51.69	kJ/mol	Joback Calculated Property
log10WS	-11.17		Crippen Calculated Property
logPoct/wat	10.240		Crippen Calculated Property
McVol	372.460	ml/mol	McGowan Calculated Property
Pc	627.19	kPa	Joback Calculated Property
Inp	[1836.00; 1836.00]
Inp	1836.00		NIST
Inp	1836.00		NIST
Tboil	763.68	K	Joback Calculated Property
Tc	941.34	K	Joback Calculated Property
Tfus	450.52	K	Joback Calculated Property
Vc	1.565	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1229.00; 1320.66]	J/mol×K	[763.68; 941.34]
Cp,gas	1229.00	J/mol×K	763.68	Joback Calculated Property
Cp,gas	1246.81	J/mol×K	793.29	Joback Calculated Property
Cp,gas	1263.44	J/mol×K	822.90	Joback Calculated Property
Cp,gas	1279.00	J/mol×K	852.51	Joback Calculated Property
Cp,gas	1293.63	J/mol×K	882.12	Joback Calculated Property
Cp,gas	1307.47	J/mol×K	911.73	Joback Calculated Property
Cp,gas	1320.66	J/mol×K	941.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to Heptadecafluorononanoic acid, tetradecyl ester.

Sources

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

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