Chemical Properties of Benzamide, N,N-didecyl-2-trifluoromethyl-

InChI

InChI=1S/C28H46F3NO/c1-3-5-7-9-11-13-15-19-23-32(24-20-16-14-12-10-8-6-4-2)27(33)25-21-17-18-22-26(25)28(29,30)31/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3

InChI Key

RAWZOCXNDIULEV-UHFFFAOYSA-N

Formula

C28H46F3NO

SMILES

CCCCCCCCCCN(CCCCCCCCCC)C(=O)c1ccccc1C(F)(F)F

Molecular Weight¹

469.68

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	68.37	kJ/mol	Joback Calculated Property
log10WS	-8.32		Relay (1.0) Calculated Property
logPoct/wat	9.429		Crippen Calculated Property
McVol	398.480	ml/mol	McGowan Calculated Property
Pc	752.67	kPa	Joback Calculated Property
Inp	[2927.00; 2927.00]
Inp	2927.00		NIST
Inp	2927.00		NIST
Tfus	307.84	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[584.33; 1392.04]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-5.17020e+01
Coefficient B			2.78254e+00
Coefficient C			-1.77846e-03
Coefficient D			4.39660e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	584.33	J/mol×K	273.00	Calculated Property
Cp,gas	729.58	J/mol×K	353.78	Calculated Property
Cp,gas	857.70	J/mol×K	434.56	Calculated Property
Cp,gas	970.10	J/mol×K	515.33	Calculated Property
Cp,gas	1068.16	J/mol×K	596.11	Calculated Property
Cp,gas	1153.27	J/mol×K	676.89	Calculated Property
Cp,gas	1226.82	J/mol×K	757.67	Calculated Property
Cp,gas	1290.21	J/mol×K	838.44	Calculated Property
Cp,gas	1344.82	J/mol×K	919.22	Calculated Property
Cp,gas	1392.04	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, N,N-didecyl-2-trifluoromethyl-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.