Chemical Properties of Glycine, N-trifluoroacetyl-, isopropyl ester

InChI

InChI=1S/C7H10F3NO3/c1-4(2)14-5(12)3-11-6(13)7(8,9)10/h4H,3H2,1-2H3,(H,11,13)

InChI Key

NMMHHNLBWAZRMW-UHFFFAOYSA-N

Formula

C7H10F3NO3

SMILES

CC(C)OC(=O)CNC(=O)C(F)(F)F

Molecular Weight¹

213.16

Other Names

• Glycine, N-trifluoroacetyl, 1-methylethyl ester
• Glycine, trifluoroacetyl, isopropyl ester

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[325.06; 381.08]	J/mol×K	[516.16; 690.58]
Cp,gas	325.06	J/mol×K	516.16	Joback Calculated Property
Cp,gas	335.80	J/mol×K	545.23	Joback Calculated Property
Cp,gas	345.96	J/mol×K	574.30	Joback Calculated Property
Cp,gas	355.56	J/mol×K	603.37	Joback Calculated Property
Cp,gas	364.59	J/mol×K	632.44	Joback Calculated Property
Cp,gas	373.10	J/mol×K	661.51	Joback Calculated Property
Cp,gas	381.08	J/mol×K	690.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-trifluoroacetyl-, isopropyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
These property values are available through the Cheméo API. A free account gives you an access key.