Chemical Properties of 2-(N-Ethyl-N-tolylamino)ethanol, trifluoroacetate

InChI

InChI=1S/C13H16F3NO2/c1-3-17(11-6-4-5-10(2)9-11)7-8-19-12(18)13(14,15)16/h4-6,9H,3,7-8H2,1-2H3

InChI Key

VOTYPCCKAXDIQK-UHFFFAOYSA-N

Formula

C13H16F3NO2

SMILES

CCN(CCOC(=O)C(F)(F)F)c1cccc(C)c1

Molecular Weight¹

275.27

• 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	0.6034		Relay (1.0) Calculated Property
ΔfG°	-543.37	kJ/mol	Joback Calculated Property
ΔfH°gas	-938.67	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	30.71	kJ/mol	Joback Calculated Property
ΔvapH°	75.56	kJ/mol	Relay (1.0) Calculated Property
IE	7.87	eV	Relay (1.0) Calculated Property
log10WS	-3.20		Relay (1.0) Calculated Property
logPoct/wat	2.927		Crippen Calculated Property
McVol	193.000	ml/mol	McGowan Calculated Property
Pc	2025.41	kPa	Joback Calculated Property
Inp	[1478.00; 1478.00]
Inp	1478.00		NIST
Inp	1478.00		NIST
Tboil	538.79	K	Relay (1.0) Calculated Property
Tc	701.73	K	Relay (1.0) Calculated Property
Tfus	275.67	K	Relay (1.0) Calculated Property
Vc	0.690	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[507.87; 583.06]	J/mol×K	[611.81; 798.28]
Cp,gas	507.87	J/mol×K	611.81	Joback Calculated Property
Cp,gas	522.47	J/mol×K	642.89	Joback Calculated Property
Cp,gas	536.19	J/mol×K	673.97	Joback Calculated Property
Cp,gas	549.07	J/mol×K	705.05	Joback Calculated Property
Cp,gas	561.16	J/mol×K	736.13	Joback Calculated Property
Cp,gas	572.47	J/mol×K	767.21	Joback Calculated Property
Cp,gas	583.06	J/mol×K	798.28	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(N-Ethyl-N-tolylamino)ethanol, trifluoroacetate.

Sources

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

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