Chemical Properties of Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-hept-2-yl-

InChI

InChI=1S/C20H29F4NO/c1-4-6-8-11-15(3)25(14-9-7-5-2)19(26)16-12-10-13-17(18(16)21)20(22,23)24/h10,12-13,15H,4-9,11,14H2,1-3H3

InChI Key

NIVNXVKDDGAZJT-UHFFFAOYSA-N

Formula

C20H29F4NO

SMILES

CCCCCC(C)N(CCCCC)C(=O)c1cccc(C(F)(F)F)c1F

Molecular Weight¹

375.44

• 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°	-586.31	kJ/mol	Joback Calculated Property
ΔfH°gas	-1086.06	kJ/mol	Joback Calculated Property
ΔfusH°	46.82	kJ/mol	Joback Calculated Property
ΔvapH°	67.55	kJ/mol	Joback Calculated Property
log10WS	-7.35		Crippen Calculated Property
logPoct/wat	6.446		Crippen Calculated Property
McVol	287.530	ml/mol	McGowan Calculated Property
Pc	1165.63	kPa	Joback Calculated Property
Inp	[2694.00; 2694.00]
Inp	2694.00		NIST
Inp	2694.00		NIST
Tboil	753.36	K	Joback Calculated Property
Tc	933.55	K	Joback Calculated Property
Tfus	438.80	K	Joback Calculated Property
Vc	1.127	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[869.87; 958.23]	J/mol×K	[753.36; 933.55]
Cp,gas	869.87	J/mol×K	753.36	Joback Calculated Property
Cp,gas	886.83	J/mol×K	783.39	Joback Calculated Property
Cp,gas	902.82	J/mol×K	813.42	Joback Calculated Property
Cp,gas	917.90	J/mol×K	843.45	Joback Calculated Property
Cp,gas	932.13	J/mol×K	873.49	Joback Calculated Property
Cp,gas	945.56	J/mol×K	903.52	Joback Calculated Property
Cp,gas	958.23	J/mol×K	933.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-hept-2-yl-.

Sources

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

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