Chemical Properties of 3-(2-Ethylhexyloxy)-propylamine (CAS 5397-31-9)

InChI

InChI=1S/C11H25NO/c1-3-5-7-11(4-2)10-13-9-6-8-12/h11H,3-10,12H2,1-2H3

InChI Key

DVFGEIYOLIFSRX-UHFFFAOYSA-N

Formula

C11H25NO

SMILES

CCCCC(CC)COCCCN

Molecular Weight¹

187.32

CAS

5397-31-9

Other Names

• 1-Propanamine, 3-[(2-ethylhexyl)oxy]-
• Propylamine, 3-(2-ethylhexoxy)-
• Propylamine, 3-((2-ethylhexyl)oxy)-
• 2-Ethylhexyl 3-aminopropyl ether
• 3-(2-Ethylhexoxy)propylamine
• NSC 1078
• 3-(2-Ethylhexoxy)propan-1-amine

• 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	0.6477		Relay (1.0) Calculated Property
ΔfG°	0.75	kJ/mol	Joback Calculated Property
ΔfH°gas	-382.90	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	27.11	kJ/mol	Joback Calculated Property
ΔvapH°	63.53	kJ/mol	Relay (1.0) Calculated Property
IE	8.82	eV	Relay (1.0) Calculated Property
log10WS	-2.63		Relay (1.0) Calculated Property
logPoct/wat	2.568		Crippen Calculated Property
McVol	181.700	ml/mol	McGowan Calculated Property
Pc	2018.13	kPa	Joback Calculated Property
Inp	[1357.00; 1357.00]
Inp	1357.00		NIST
Inp	1357.00		NIST
Tboil	517.97	K	Relay (1.0) Calculated Property
Tc	684.98	K	Relay (1.0) Calculated Property
Tfus	210.53	K	Relay (1.0) Calculated Property
Vc	0.641	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[458.32; 545.86]	J/mol×K	[545.59; 721.22]
Cp,gas	458.32	J/mol×K	545.59	Joback Calculated Property
Cp,gas	474.50	J/mol×K	574.86	Joback Calculated Property
Cp,gas	490.03	J/mol×K	604.13	Joback Calculated Property
Cp,gas	504.92	J/mol×K	633.40	Joback Calculated Property
Cp,gas	519.18	J/mol×K	662.67	Joback Calculated Property
Cp,gas	532.82	J/mol×K	691.94	Joback Calculated Property
Cp,gas	545.86	J/mol×K	721.22	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-(2-Ethylhexyloxy)-propylamine.

Sources

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

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