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

InChI

InChI=1S/C18H25F4NO/c1-4-5-6-11-23(12-10-13(2)3)17(24)14-8-7-9-15(16(14)19)18(20,21)22/h7-9,13H,4-6,10-12H2,1-3H3

InChI Key

ZPZBOJDBMAYOIE-UHFFFAOYSA-N

Formula

C18H25F4NO

SMILES

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

Molecular Weight¹

347.39

• 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	0.7739		Relay (1.0) Calculated Property
ΔfG°	-603.15	kJ/mol	Joback Calculated Property
ΔfH°gas	-1110.73	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	41.64	kJ/mol	Joback Calculated Property
ΔvapH°	77.20	kJ/mol	Relay (1.0) Calculated Property
IE	8.72	eV	Relay (1.0) Calculated Property
log10WS	-5.64		Relay (1.0) Calculated Property
logPoct/wat	5.523		Crippen Calculated Property
McVol	259.350	ml/mol	McGowan Calculated Property
Pc	1334.91	kPa	Joback Calculated Property
Inp	[2309.00; 2309.00]
Inp	2309.00		NIST
Inp	2309.00		NIST
Tboil	602.40	K	Relay (1.0) Calculated Property
Tc	773.22	K	Relay (1.0) Calculated Property
Tfus	297.28	K	Relay (1.0) Calculated Property
Vc	0.955	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[755.49; 840.41]	J/mol×K	[707.60; 886.64]
Cp,gas	755.49	J/mol×K	707.60	Joback Calculated Property
Cp,gas	771.81	J/mol×K	737.44	Joback Calculated Property
Cp,gas	787.19	J/mol×K	767.28	Joback Calculated Property
Cp,gas	801.70	J/mol×K	797.12	Joback Calculated Property
Cp,gas	815.37	J/mol×K	826.96	Joback Calculated Property
Cp,gas	828.26	J/mol×K	856.80	Joback Calculated Property
Cp,gas	840.41	J/mol×K	886.64	Joback Calculated Property

Similar Compounds

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

Sources

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

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