Chemical Properties of Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester

InChI

InChI=1S/C30H50F8O4/c1-2-3-4-5-6-7-8-9-10-11-14-17-20-23-41-25(39)21-18-15-12-13-16-19-22-26(40)42-24-28(33,34)30(37,38)29(35,36)27(31)32/h27H,2-24H2,1H3

InChI Key

UJWGLBYDPPCTOY-UHFFFAOYSA-N

Formula

C30H50F8O4

SMILES

CCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

626.70

• 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°	-1818.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-2752.54	kJ/mol	Joback Calculated Property
ΔfusH°	77.91	kJ/mol	Joback Calculated Property
ΔvapH°	89.87	kJ/mol	Joback Calculated Property
log10WS	-11.36		Crippen Calculated Property
logPoct/wat	10.456		Crippen Calculated Property
McVol	462.600	ml/mol	McGowan Calculated Property
Pc	540.58	kPa	Joback Calculated Property
Inp	[3101.00; 3101.00]
Inp	3101.00		NIST
Inp	3101.00		NIST
Tboil	1022.41	K	Joback Calculated Property
Tc	1316.99	K	Joback Calculated Property
Tfus	569.16	K	Joback Calculated Property
Vc	1.869	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1656.46; 1787.98]	J/mol×K	[1022.41; 1316.99]
Cp,gas	1656.46	J/mol×K	1022.41	Joback Calculated Property
Cp,gas	1682.82	J/mol×K	1071.51	Joback Calculated Property
Cp,gas	1706.94	J/mol×K	1120.60	Joback Calculated Property
Cp,gas	1729.18	J/mol×K	1169.70	Joback Calculated Property
Cp,gas	1749.88	J/mol×K	1218.79	Joback Calculated Property
Cp,gas	1769.36	J/mol×K	1267.89	Joback Calculated Property
Cp,gas	1787.98	J/mol×K	1316.99	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentadecyl ester.

Sources

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

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