Chemical Properties of trans-Cinnamamide, n-heptyl-n-octyl-3-trifluoromethyl-

InChI

InChI=1S/C25H38F3NO/c1-3-5-7-9-11-13-20-29(19-12-10-8-6-4-2)24(30)18-17-22-15-14-16-23(21-22)25(26,27)28/h14-18,21H,3-13,19-20H2,1-2H3/b18-17+

InChI Key

BQDWRCAUWXEUTQ-ISLYRVAYSA-N

Formula

C25H38F3NO

SMILES

CCCCCCCCN(CCCCCCC)C(=O)C=Cc1cccc(C(F)(F)F)c1

Molecular Weight¹

425.57

• 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°	-257.11	kJ/mol	Joback Calculated Property
ΔfH°gas	-859.18	kJ/mol	Joback Calculated Property
ΔfusH°	60.81	kJ/mol	Joback Calculated Property
ΔvapH°	79.18	kJ/mol	Joback Calculated Property
log10WS	-8.44		Crippen Calculated Property
logPoct/wat	7.878		Crippen Calculated Property
McVol	351.910	ml/mol	McGowan Calculated Property
Pc	915.50	kPa	Joback Calculated Property
Inp	[2725.00; 2725.00]
Inp	2725.00		NIST
Inp	2725.00		NIST
Tboil	868.11	K	Joback Calculated Property
Tc	1063.72	K	Joback Calculated Property
Tfus	491.96	K	Joback Calculated Property
Vc	1.375	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1137.20; 1235.57]	J/mol×K	[868.11; 1063.72]
Cp,gas	1137.20	J/mol×K	868.11	Joback Calculated Property
Cp,gas	1155.83	J/mol×K	900.71	Joback Calculated Property
Cp,gas	1173.44	J/mol×K	933.31	Joback Calculated Property
Cp,gas	1190.13	J/mol×K	965.92	Joback Calculated Property
Cp,gas	1205.98	J/mol×K	998.52	Joback Calculated Property
Cp,gas	1221.10	J/mol×K	1031.12	Joback Calculated Property
Cp,gas	1235.57	J/mol×K	1063.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-Cinnamamide, n-heptyl-n-octyl-3-trifluoromethyl-.

Sources

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

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