Chemical Properties of Triethylene glycol, amino, N-octyl

InChI

InChI=1S/C14H31NO3/c1-2-3-4-5-6-7-8-15-9-11-17-13-14-18-12-10-16/h15-16H,2-14H2,1H3

InChI Key

XWQKDPZFMJPQGR-UHFFFAOYSA-N

Formula

C14H31NO3

SMILES

CCCCCCCCNCCOCCOCCO

Molecular Weight¹

261.40

• 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	1.0083		Relay (1.0) Calculated Property
ΔfG°	-190.43	kJ/mol	Joback Calculated Property
ΔfH°gas	-699.55	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	43.58	kJ/mol	Joback Calculated Property
ΔvapH°	95.19	kJ/mol	Relay (1.0) Calculated Property
IE	8.70	eV	Relay (1.0) Calculated Property
log10WS	-1.81		Relay (1.0) Calculated Property
logPoct/wat	1.962		Crippen Calculated Property
McVol	235.710	ml/mol	McGowan Calculated Property
Pc	1611.58	kPa	Joback Calculated Property
Inp	[1917.00; 1917.00]
Inp	1917.00		NIST
Inp	1917.00		NIST
Tboil	620.32	K	Relay (1.0) Calculated Property
Tc	773.64	K	Relay (1.0) Calculated Property
Tfus	285.06	K	Relay (1.0) Calculated Property
Vc	0.888	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[702.80; 786.31]	J/mol×K	[706.91; 873.27]
Cp,gas	702.80	J/mol×K	706.91	Joback Calculated Property
Cp,gas	718.41	J/mol×K	734.64	Joback Calculated Property
Cp,gas	733.34	J/mol×K	762.36	Joback Calculated Property
Cp,gas	747.58	J/mol×K	790.09	Joback Calculated Property
Cp,gas	761.15	J/mol×K	817.82	Joback Calculated Property
Cp,gas	774.06	J/mol×K	845.54	Joback Calculated Property
Cp,gas	786.31	J/mol×K	873.27	Joback Calculated Property

Similar Compounds

Find more compounds similar to Triethylene glycol, amino, N-octyl.

Sources

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

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