Chemical Properties of 4-ACETYLBENZOIC ACID

InChI

InChI=1S/C9H8O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3,(H,11,12)

InChI Key

QBHDSQZASIBAAI-UHFFFAOYSA-N

Formula

C9H8O3

SMILES

CC(=O)c1ccc(C(=O)O)cc1

Molecular Weight¹

164.16

Other Names

• Benzoic acid, 4-acetyl-
• p-carboxyacetophenone

• 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.
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[293.88; 343.25]	J/mol×K	[636.56; 868.71]
Cp,gas	293.88	J/mol×K	636.56	Joback Calculated Property
Cp,gas	303.85	J/mol×K	675.25	Joback Calculated Property
Cp,gas	313.06	J/mol×K	713.94	Joback Calculated Property
Cp,gas	321.57	J/mol×K	752.64	Joback Calculated Property
Cp,gas	329.41	J/mol×K	791.33	Joback Calculated Property
Cp,gas	336.62	J/mol×K	830.02	Joback Calculated Property
Cp,gas	343.25	J/mol×K	868.71	Joback Calculated Property
η	[0.0002372; 0.0010686]	Pa×s	[440.66; 636.56]
η	0.0010686	Pa×s	440.66	Joback Calculated Property
η	0.0007626	Pa×s	473.31	Joback Calculated Property
η	0.0005685	Pa×s	505.96	Joback Calculated Property
η	0.0004391	Pa×s	538.61	Joback Calculated Property
η	0.0003493	Pa×s	571.26	Joback Calculated Property
η	0.0002849	Pa×s	603.91	Joback Calculated Property
η	0.0002372	Pa×s	636.56	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-ACETYLBENZOIC ACID.

Mixtures

• 4-ACETYLBENZOIC ACID + Water

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Determination and modeling of aqueous solubility of 4-position substituted benzoic acid compounds in a high-temperature solution
• Joback Method
• McGowan Method
• NIST Webbook

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