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

InChI

InChI=1S/C20H29F4NO/c1-3-5-7-8-10-15-25(14-9-6-4-2)19(26)16-12-11-13-17(18(16)21)20(22,23)24/h11-13H,3-10,14-15H2,1-2H3

InChI Key

ORJAYIOWISLTOT-UHFFFAOYSA-N

Formula

C20H29F4NO

SMILES

CCCCCCCN(CCCCC)C(=O)c1cccc(C(F)(F)F)c1F

Molecular Weight¹

375.44

• ω : Acentric Factor.
• 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).
• 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).
• 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
ω	0.8924		Relay (1.0) Calculated Property
ΔfG°	-583.87	kJ/mol	Joback Calculated Property
ΔfH°gas	-1133.08	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	50.34	kJ/mol	Joback Calculated Property
ΔvapH°	85.97	kJ/mol	Relay (1.0) Calculated Property
IE	8.69	eV	Relay (1.0) Calculated Property
log10WS	-6.44		Relay (1.0) Calculated Property
logPoct/wat	6.447		Crippen Calculated Property
McVol	287.530	ml/mol	McGowan Calculated Property
Pc	1159.29	kPa	Joback Calculated Property
Inp	[2591.00; 2591.00]
Inp	2591.00		NIST
Inp	2591.00		NIST
Tboil	624.04	K	Relay (1.0) Calculated Property
Tc	800.58	K	Relay (1.0) Calculated Property
Tfus	294.98	K	Relay (1.0) Calculated Property
Vc	1.072	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[869.38; 957.15]	J/mol×K	[753.80; 932.48]
Cp,gas	869.38	J/mol×K	753.80	Joback Calculated Property
Cp,gas	886.18	J/mol×K	783.58	Joback Calculated Property
Cp,gas	902.04	J/mol×K	813.36	Joback Calculated Property
Cp,gas	917.02	J/mol×K	843.14	Joback Calculated Property
Cp,gas	931.16	J/mol×K	872.92	Joback Calculated Property
Cp,gas	944.52	J/mol×K	902.70	Joback Calculated Property
Cp,gas	957.15	J/mol×K	932.48	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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