Chemical Properties of 2-Hydroxyacetophenone

InChI

InChI=1S/C8H8O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,9H,6H2

InChI Key

ZWVHTXAYIKBMEE-UHFFFAOYSA-N

Formula

C8H8O2

SMILES

O=C(CO)c1ccccc1

Molecular Weight¹

136.15

Other Names

• (hydroxyacetyl)benzene
• 2-Hydroxy-phenylethanone
• 2-hydroxy-1-phenylethan-1-one
• 2-hydroxy-1-phenylethanone
• Acetophenone, 2-hydroxy-
• Acetophenone, alpha-hydroxy-
• Acetophenone, «alpha»-hydroxy-
• Benzoylcarbinol
• Glycolophenone
• Methanol, benzoyl-
• NSC 171232
• Phenacyl alcohol
• alpha-Hydroxyacetophenone
• benzoylmethanol
• hydroxymethyl phenyl ketone
• «alpha»-Hydroxyacetophenone
• «omega»-Hydroxyacetophenone

• 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 : 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	0.6508		Relay (1.0) Calculated Property
ΔfG°	-136.85	kJ/mol	Joback Calculated Property
ΔfH°gas	-243.05	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	16.20	kJ/mol	Joback Calculated Property
ΔvapH°	78.28	kJ/mol	Relay (1.0) Calculated Property
IE	9.33 ± 0.05	eV	NIST
log10WS	-1.04		Relay (1.0) Calculated Property
logPoct/wat	0.862		Crippen Calculated Property
McVol	107.260	ml/mol	McGowan Calculated Property
Pc	4444.44	kPa	Joback Calculated Property
I	[1762.00; 1771.00]
I	1762.00		NIST
I	1771.00		NIST
I	1762.00		NIST
Tboil	527.82	K	Relay (1.0) Calculated Property
Tc	783.59	K	Relay (1.0) Calculated Property
Tfus	330.51	K	Relay (1.0) Calculated Property
Vc	0.376	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[236.83; 285.78]	J/mol×K	[555.37; 761.75]
Cp,gas	236.83	J/mol×K	555.37	Joback Calculated Property
Cp,gas	246.43	J/mol×K	589.77	Joback Calculated Property
Cp,gas	255.42	J/mol×K	624.16	Joback Calculated Property
Cp,gas	263.82	J/mol×K	658.56	Joback Calculated Property
Cp,gas	271.66	J/mol×K	692.96	Joback Calculated Property
Cp,gas	278.97	J/mol×K	727.35	Joback Calculated Property
Cp,gas	285.78	J/mol×K	761.75	Joback Calculated Property
η	[0.0001263; 0.0079644]	Pa×s	[317.09; 555.37]
η	0.0079644	Pa×s	317.09	Joback Calculated Property
η	0.0027179	Pa×s	356.80	Joback Calculated Property
η	0.0011504	Pa×s	396.52	Joback Calculated Property
η	0.0005694	Pa×s	436.23	Joback Calculated Property
η	0.0003169	Pa×s	475.94	Joback Calculated Property
η	0.0001931	Pa×s	515.66	Joback Calculated Property
η	0.0001263	Pa×s	555.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Hydroxyacetophenone.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Effect of halogen substitution on the enthalpies of solvation and hydrogen bonding of organic solutes in chlorobenzene and 1,2-dichlorobenzene derived using multi-parameter correlations
• Joback Method
• McGowan Method
• NIST Webbook

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