Chemical Properties of Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-pentyl-

InChI

InChI=1S/C21H17F8NO2/c1-2-3-4-11-30(18(31)12-7-5-9-14(16(12)22)20(24,25)26)19(32)13-8-6-10-15(17(13)23)21(27,28)29/h5-10H,2-4,11H2,1H3

InChI Key

ZNNXVRPDATVDRD-UHFFFAOYSA-N

Formula

C21H17F8NO2

SMILES

CCCCCN(C(=O)c1cccc(C(F)(F)F)c1F)C(=O)c1cccc(C(F)(F)F)c1F

Molecular Weight¹

467.35

• 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).
• 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
ΔfG°	-1387.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-1793.60	kJ/mol	Joback Calculated Property
ΔfusH°	52.70	kJ/mol	Joback Calculated Property
ΔvapH°	75.95	kJ/mol	Joback Calculated Property
log10WS	-8.13		Crippen Calculated Property
logPoct/wat	6.475		Crippen Calculated Property
McVol	286.510	ml/mol	McGowan Calculated Property
Pc	1248.61	kPa	Joback Calculated Property
Inp	[2040.00; 2040.00]
Inp	2040.00		NIST
Inp	2040.00		NIST
Tboil	861.04	K	Joback Calculated Property
Tc	1059.25	K	Joback Calculated Property
Tfus	571.24	K	Joback Calculated Property
Vc	1.147	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[883.19; 945.14]	J/mol×K	[861.04; 1059.25]
Cp,gas	883.19	J/mol×K	861.04	Joback Calculated Property
Cp,gas	895.38	J/mol×K	894.08	Joback Calculated Property
Cp,gas	906.72	J/mol×K	927.11	Joback Calculated Property
Cp,gas	917.27	J/mol×K	960.15	Joback Calculated Property
Cp,gas	927.14	J/mol×K	993.18	Joback Calculated Property
Cp,gas	936.40	J/mol×K	1026.22	Joback Calculated Property
Cp,gas	945.14	J/mol×K	1059.25	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-pentyl-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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