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

InChI

InChI=1S/C26H42F8O4/c1-2-3-4-5-6-7-10-13-16-19-37-21(35)17-14-11-8-9-12-15-18-22(36)38-20-24(29,30)26(33,34)25(31,32)23(27)28/h23H,2-20H2,1H3

InChI Key

OKGQSDAHKXVHCG-UHFFFAOYSA-N

Formula

C26H42F8O4

SMILES

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

Molecular Weight¹

570.60

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	1.2751		Relay (... Calculated Property
ΔfG°	-1852.20	kJ/mol	Joback Calculated Property
ΔfH°gas	-2738.88	kJ/mol	Relay (... Calculated Property
ΔfusH°	67.54	kJ/mol	Joback Calculated Property
ΔvapH°	121.38	kJ/mol	Relay (... Calculated Property
IE	10.11	eV	Relay (... Calculated Property
log10WS	-8.61		Relay (... Calculated Property
logPoct/wat	8.895		Crippen Calculated Property
McVol	406.240	ml/mol	McGowan Calculated Property
Pc	651.77	kPa	Joback Calculated Property
Inp	[2703.00; 2703.00]
Inp	2703.00		NIST
Inp	2703.00		NIST
Tboil	656.18	K	Relay (... Calculated Property
Tc	779.56	K	Relay (... Calculated Property
Tfus	319.05	K	Relay (... Calculated Property
Vc	1.547	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1400.30; 1507.05]	J/mol×K	[930.89; 1162.11]
Cp,gas	1400.30	J/mol×K	930.89	Joback Calculated Property
Cp,gas	1421.52	J/mol×K	969.43	Joback Calculated Property
Cp,gas	1441.18	J/mol×K	1007.96	Joback Calculated Property
Cp,gas	1459.41	J/mol×K	1046.50	Joback Calculated Property
Cp,gas	1476.37	J/mol×K	1085.04	Joback Calculated Property
Cp,gas	1492.20	J/mol×K	1123.58	Joback Calculated Property
Cp,gas	1507.05	J/mol×K	1162.11	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.