Chemical Properties of Phenol, 4-(2-aminoethyl)- (CAS 51-67-2)

InChI

InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2

InChI Key

DZGWFCGJZKJUFP-UHFFFAOYSA-N

Formula

C8H11NO

SMILES

NCCc1ccc(O)cc1

Molecular Weight¹

137.18

CAS

51-67-2

Other Names

• 2-(4'-Hydroxyphenyl)ethylamine
• 2-(4-Hydroxyphenyl)ethylamine
• 2-(p-Hydroxyphenyl)ethylamine
• 4-(2-Aminoethyl)phenol
• 4-Hydroxy-«beta»-phenylethylamine
• 4-Hydroxy-«beta»-phenylethylamine
• 4-Hydroxyphenethylamine
• 4-Hydroxyphenylethylamine
• Benzeneethanamine, 4-hydroxy-
• NSC 249188
• Phenethylamine, p-hydroxy-
• Phenol, p-(2-aminoethyl)-
• Systogene
• Tenosin-Wirkstoff
• Tocosine
• Tyramin
• Tyramine
• Tyramine base
• Tyrosamine
• Uteramine
• p-(2-Aminoethyl)phenol
• p-Hydroxy-«beta»-phenethylamine
• p-Hydroxy-«beta»-phenylethylamine
• p-Hydroxy-«beta»-phenethylamine
• p-Hydroxy-«beta»-phenylethylamine
• p-Hydroxyphenethylamine
• p-Hydroxyphenylethylamine
• p-Tyramine
• p-«beta»-Aminoethylphenol
• p-«beta»-Aminoethylphenol
• «alpha»-(4-Hydroxyphenyl)-«beta»-aminoethane
• «beta»-(4-Hydroxyphenyl)ethylamine
• «alpha»-(4-Hydroxyphenyl)-«beta»-aminoethane
• «beta»-(4-Hydroxyphenyl)ethylamine

• 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_boilr : Boiling point at reduced pressure (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	0.6357		Relay (1.0) Calculated Property
ΔfG°	40.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-106.18	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	21.50	kJ/mol	Joback Calculated Property
ΔvapH°	75.32	kJ/mol	Relay (1.0) Calculated Property
IE	8.41 ± 0.12	eV	NIST
log10WS	-1.12		Aq. Solubility Prediction
logPoct/wat	0.893		Crippen Calculated Property
McVol	115.670	ml/mol	McGowan Calculated Property
Pc	4762.81	kPa	Joback Calculated Property
Inp	[1405.00; 1660.90]
Inp	1405.00		NIST
Inp	1430.00		NIST
Inp	1660.90		NIST
Inp	1436.00		NIST
Inp	1436.00		NIST
Inp	1660.90		NIST
Tboil	550.15	K	Relay (1.0) Calculated Property
Tc	775.05	K	Relay (1.0) Calculated Property
Tfus	437.32	K	Aq. Solubility Prediction
Vc	0.380	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[276.50; 334.74]	J/mol×K	[562.27; 798.02]
Cp,gas	276.50	J/mol×K	562.27	Joback Calculated Property
Cp,gas	288.09	J/mol×K	601.56	Joback Calculated Property
Cp,gas	298.81	J/mol×K	640.85	Joback Calculated Property
Cp,gas	308.74	J/mol×K	680.15	Joback Calculated Property
Cp,gas	317.98	J/mol×K	719.44	Joback Calculated Property
Cp,gas	326.61	J/mol×K	758.73	Joback Calculated Property
Cp,gas	334.74	J/mol×K	798.02	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Phenol, 4-(2-aminoethyl)-.

Sources

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

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