Chemical Properties of Glutaric acid, 2-methylpent-3-yl 2,2,3,3,3-pentafluoropropyl ester

InChI

InChI=1S/C14H21F5O4/c1-4-10(9(2)3)23-12(21)7-5-6-11(20)22-8-13(15,16)14(17,18)19/h9-10H,4-8H2,1-3H3

InChI Key

MTZXVCSSSMGAGE-UHFFFAOYSA-N

Formula

C14H21F5O4

SMILES

CCC(OC(=O)CCCC(=O)OCC(F)(F)C(F)(F)F)C(C)C

Molecular Weight¹

348.31

• 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	0.7512		Relay (... Calculated Property
ΔfG°	-1374.09	kJ/mol	Joback Calculated Property
ΔfH°gas	-1999.68	kJ/mol	Relay (... Calculated Property
ΔfusH°	31.12	kJ/mol	Joback Calculated Property
ΔvapH°	72.09	kJ/mol	Relay (... Calculated Property
IE	10.11	eV	Relay (... Calculated Property
log10WS	-4.09		Relay (... Calculated Property
logPoct/wat	3.875		Crippen Calculated Property
McVol	231.850	ml/mol	McGowan Calculated Property
Pc	1433.72	kPa	Joback Calculated Property
Inp	[1405.00; 1405.00]
Inp	1405.00		NIST
Inp	1405.00		NIST
Tboil	520.57	K	Relay (... Calculated Property
Tc	634.13	K	Relay (... Calculated Property
Tfus	255.56	K	Relay (... Calculated Property
Vc	0.854	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[667.97; 742.89]	J/mol×K	[661.31; 827.94]
Cp,gas	667.97	J/mol×K	661.31	Joback Calculated Property
Cp,gas	682.30	J/mol×K	689.08	Joback Calculated Property
Cp,gas	695.86	J/mol×K	716.85	Joback Calculated Property
Cp,gas	708.67	J/mol×K	744.62	Joback Calculated Property
Cp,gas	720.77	J/mol×K	772.40	Joback Calculated Property
Cp,gas	732.17	J/mol×K	800.17	Joback Calculated Property
Cp,gas	742.89	J/mol×K	827.94	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-methylpent-3-yl 2,2,3,3,3-pentafluoropropyl ester.

Sources

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

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