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

InChI

InChI=1S/C19H27F4NO/c1-3-5-7-9-14-24(13-8-6-4-2)18(25)15-11-10-12-16(17(15)20)19(21,22)23/h10-12H,3-9,13-14H2,1-2H3

InChI Key

GWUGYDOCVWTPJX-UHFFFAOYSA-N

Formula

C19H27F4NO

SMILES

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

Molecular Weight¹

361.42

• 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	0.8540		Relay (1.0) Calculated Property
ΔfG°	-592.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-1113.05	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	47.75	kJ/mol	Joback Calculated Property
ΔvapH°	82.99	kJ/mol	Relay (1.0) Calculated Property
IE	8.70	eV	Relay (1.0) Calculated Property
log10WS	-6.11		Relay (1.0) Calculated Property
logPoct/wat	6.057		Crippen Calculated Property
McVol	273.440	ml/mol	McGowan Calculated Property
Pc	1238.96	kPa	Joback Calculated Property
Inp	[2423.00; 2423.00]
Inp	2423.00		NIST
Inp	2423.00		NIST
Tboil	613.76	K	Relay (1.0) Calculated Property
Tc	790.44	K	Relay (1.0) Calculated Property
Tfus	292.27	K	Relay (1.0) Calculated Property
Vc	1.018	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[811.69; 897.60]	J/mol×K	[730.92; 908.48]
Cp,gas	811.69	J/mol×K	730.92	Joback Calculated Property
Cp,gas	828.14	J/mol×K	760.51	Joback Calculated Property
Cp,gas	843.67	J/mol×K	790.11	Joback Calculated Property
Cp,gas	858.34	J/mol×K	819.70	Joback Calculated Property
Cp,gas	872.18	J/mol×K	849.29	Joback Calculated Property
Cp,gas	885.25	J/mol×K	878.89	Joback Calculated Property
Cp,gas	897.60	J/mol×K	908.48	Joback Calculated Property

Similar Compounds

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

Sources

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

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