Chemical Properties of Benzamide, N-tetrahydrofurfuryl-2,3,4-trifluoro-

InChI

InChI=1S/C12H12F3NO2/c13-9-4-3-8(10(14)11(9)15)12(17)16-6-7-2-1-5-18-7/h3-4,7H,1-2,5-6H2,(H,16,17)

InChI Key

IDBKYQDSGBWNNT-UHFFFAOYSA-N

Formula

C12H12F3NO2

SMILES

O=C(NCC1CCCO1)c1ccc(F)c(F)c1F

Molecular Weight¹

259.22

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[236.28; 560.71]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.77690e+01
Coefficient B			1.09870e+00
Coefficient C			-6.51680e-04
Coefficient D			1.31460e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	236.28	J/mol×K	273.00	Calculated Property
Cp,gas	295.18	J/mol×K	353.78	Calculated Property
Cp,gas	347.40	J/mol×K	434.56	Calculated Property
Cp,gas	393.35	J/mol×K	515.33	Calculated Property
Cp,gas	433.45	J/mol×K	596.11	Calculated Property
Cp,gas	468.11	J/mol×K	676.89	Calculated Property
Cp,gas	497.75	J/mol×K	757.67	Calculated Property
Cp,gas	522.79	J/mol×K	838.44	Calculated Property
Cp,gas	543.64	J/mol×K	919.22	Calculated Property
Cp,gas	560.71	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, N-tetrahydrofurfuryl-2,3,4-trifluoro-.

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.