Chemical Properties of Benzamide, 2-(trifluoromethyl)-N-methyl-

InChI

InChI=1S/C9H8F3NO/c1-13-8(14)6-4-2-3-5-7(6)9(10,11)12/h2-5H,1H3,(H,13,14)

InChI Key

HUQWVSQZLAQZSF-UHFFFAOYSA-N

Formula

C9H8F3NO

SMILES

CNC(=O)c1ccccc1C(F)(F)F

Molecular Weight¹

203.16

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	21.24	kJ/mol	Joback Calculated Property
IE	9.43	eV	Relay (1.0) Calculated Property
log10WS	-2.00		Relay (1.0) Calculated Property
logPoct/wat	2.065		Crippen Calculated Property
McVol	130.770	ml/mol	McGowan Calculated Property
Inp	[1366.00; 1366.00]
Inp	1366.00		NIST
Inp	1366.00		NIST
Tboil	500.09	K	Relay (1.0) Calculated Property
Tfus	339.74	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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 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	[306.50; 365.20]	J/mol×K	[535.80; 736.89]
Cp,gas	306.50	J/mol×K	535.80	Joback Calculated Property
Cp,gas	318.17	J/mol×K	569.32	Joback Calculated Property
Cp,gas	329.04	J/mol×K	602.83	Joback Calculated Property
Cp,gas	339.13	J/mol×K	636.35	Joback Calculated Property
Cp,gas	348.49	J/mol×K	669.86	Joback Calculated Property
Cp,gas	357.17	J/mol×K	703.38	Joback Calculated Property
Cp,gas	365.20	J/mol×K	736.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2-(trifluoromethyl)-N-methyl-.

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.
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