Chemical Properties of Benzeneethanol, «alpha»-ethyl- (CAS 701-70-2)

InChI

InChI=1S/C10H14O/c1-2-10(11)8-9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3

InChI Key

LYUPJHVGLFETDG-UHFFFAOYSA-N

Formula

C10H14O

SMILES

CCC(O)Cc1ccccc1

Molecular Weight¹

150.22

CAS

701-70-2

Other Names

• Phenethyl alcohol, «alpha»-ethyl-
• Benzyl ethyl carbinol
• 2-Butanol, 1-phenyl-
• «alpha»-Ethylphenethyl alcohol
• 1-Phenyl-2-butanol
• «alpha»-Ethylbenzeneethanol
• 1-phenylbutan-2-ol

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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.
• I : 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	0.5984		Relay (1.0) Calculated Property
ΔfG°	6.47	kJ/mol	Joback Calculated Property
ΔfH°gas	-189.44	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	16.26	kJ/mol	Joback Calculated Property
ΔvapH°	72.69	kJ/mol	Relay (1.0) Calculated Property
IE	8.86	eV	Relay (1.0) Calculated Property
log10WS	-1.37		Relay (1.0) Calculated Property
logPoct/wat	2.000		Crippen Calculated Property
McVol	133.870	ml/mol	McGowan Calculated Property
Pc	3276.53	kPa	Joback Calculated Property
Inp	[1222.00; 1232.00]
Inp	1222.00		NIST
Inp	1232.00		NIST
I	[1882.00; 1882.00]
I	1882.00		NIST
I	1882.00		NIST
Tboil	512.07	K	Relay (1.0) Calculated Property
Tc	712.07	K	Relay (1.0) Calculated Property
Tfus	275.63	K	Relay (1.0) Calculated Property
Vc	0.491	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[312.06; 378.75]	J/mol×K	[546.62; 743.00]
Cp,gas	312.06	J/mol×K	546.62	Joback Calculated Property
Cp,gas	324.88	J/mol×K	579.35	Joback Calculated Property
Cp,gas	336.98	J/mol×K	612.08	Joback Calculated Property
Cp,gas	348.39	J/mol×K	644.81	Joback Calculated Property
Cp,gas	359.13	J/mol×K	677.54	Joback Calculated Property
Cp,gas	369.24	J/mol×K	710.27	Joback Calculated Property
Cp,gas	378.75	J/mol×K	743.00	Joback Calculated Property
η	[0.0001002; 0.0247773]	Pa×s	[274.70; 546.62]
η	0.0247773	Pa×s	274.70	Joback Calculated Property
η	0.0051616	Pa×s	320.02	Joback Calculated Property
η	0.0015868	Pa×s	365.34	Joback Calculated Property
η	0.0006329	Pa×s	410.66	Joback Calculated Property
η	0.0003030	Pa×s	455.98	Joback Calculated Property
η	0.0001658	Pa×s	501.30	Joback Calculated Property
η	0.0001002	Pa×s	546.62	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Benzeneethanol, «alpha»-ethyl-.

Sources

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

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