Chemical Properties of L-Glutamine, N(«alpha»)-trifluoroacetyl-, 2,2,3,3,3-pentafluoropropyl ester

InChI

InChI=1S/C10H10F8N2O4/c11-8(12,10(16,17)18)3-24-6(22)4(1-2-5(19)21)20-7(23)9(13,14)15/h4H,1-3H2,(H2,19,21)(H,20,23)

InChI Key

HHVFRVCGLBJKGR-UHFFFAOYSA-N

Formula

C10H10F8N2O4

SMILES

NC(=O)CCC(NC(=O)C(F)(F)F)C(=O)OCC(F)(F)C(F)(F)F

Molecular Weight¹

374.18

• 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	0.7815		Relay (1.0) Calculated Property
ΔfG°	-1855.00	kJ/mol	Joback Calculated Property
ΔfH°gas	-2450.30	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	36.81	kJ/mol	Joback Calculated Property
ΔvapH°	81.40	kJ/mol	Relay (1.0) Calculated Property
IE	10.28	eV	Relay (1.0) Calculated Property
log10WS	-3.51		Relay (1.0) Calculated Property
logPoct/wat	1.040		Crippen Calculated Property
McVol	196.460	ml/mol	McGowan Calculated Property
Pc	2009.10	kPa	Joback Calculated Property
Inp	[1552.70; 1552.70]
Inp	1552.70		NIST
Inp	1552.70		NIST
Tboil	511.62	K	Relay (1.0) Calculated Property
Tc	687.51	K	Relay (1.0) Calculated Property
Tfus	371.94	K	Relay (1.0) Calculated Property
Vc	0.714	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[591.21; 636.64]	J/mol×K	[718.96; 894.93]
Cp,gas	591.21	J/mol×K	718.96	Joback Calculated Property
Cp,gas	600.36	J/mol×K	748.29	Joback Calculated Property
Cp,gas	608.83	J/mol×K	777.62	Joback Calculated Property
Cp,gas	616.64	J/mol×K	806.94	Joback Calculated Property
Cp,gas	623.85	J/mol×K	836.27	Joback Calculated Property
Cp,gas	630.50	J/mol×K	865.60	Joback Calculated Property
Cp,gas	636.64	J/mol×K	894.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-Glutamine, N(«alpha»)-trifluoroacetyl-, 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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