Chemical Properties of Malonic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester

InChI

InChI=1S/C18H26F8O4/c1-2-3-4-5-6-7-8-9-10-29-13(27)11-14(28)30-12-16(21,22)18(25,26)17(23,24)15(19)20/h15H,2-12H2,1H3

InChI Key

DDGPXWDETMCOGA-UHFFFAOYSA-N

Formula

C18H26F8O4

SMILES

CCCCCCCCCCOC(=O)CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

Molecular Weight¹

458.38

• 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°	-1919.56	kJ/mol	Joback Calculated Property
ΔfH°gas	-2504.86	kJ/mol	Joback Calculated Property
ΔfusH°	46.82	kJ/mol	Joback Calculated Property
ΔvapH°	63.16	kJ/mol	Joback Calculated Property
log10WS	-6.34		Crippen Calculated Property
logPoct/wat	5.775		Crippen Calculated Property
McVol	293.520	ml/mol	McGowan Calculated Property
Pc	1008.45	kPa	Joback Calculated Property
Inp	[1911.00; 1911.00]
Inp	1911.00		NIST
Inp	1911.00		NIST
Tboil	747.85	K	Joback Calculated Property
Tc	916.31	K	Joback Calculated Property
Tfus	433.92	K	Joback Calculated Property
Vc	1.196	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[915.96; 994.86]	J/mol×K	[747.85; 916.31]
Cp,gas	915.96	J/mol×K	747.85	Joback Calculated Property
Cp,gas	931.19	J/mol×K	775.93	Joback Calculated Property
Cp,gas	945.53	J/mol×K	804.00	Joback Calculated Property
Cp,gas	959.02	J/mol×K	832.08	Joback Calculated Property
Cp,gas	971.71	J/mol×K	860.16	Joback Calculated Property
Cp,gas	983.64	J/mol×K	888.24	Joback Calculated Property
Cp,gas	994.86	J/mol×K	916.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to Malonic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester.

Sources

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

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