Chemical Properties of 3-(3-Hydroxyphenyl)propionic acid (CAS 621-54-5)

InChI

InChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12)

InChI Key

QVWAEZJXDYOKEH-UHFFFAOYSA-N

Formula

C9H10O3

SMILES

O=C(O)CCc1cccc(O)c1

Molecular Weight¹

166.17

CAS

621-54-5

Other Names

• «beta»-(m-Hydroxyphenyl)propionic acid
• Benzenepropanoic acid, 3-hydroxy-
• «beta»-(3-Hydroxyphenyl)propionic acid
• m-Hydroxyphenylpropionic acid
• Hydrocinnamic acid, m-hydroxy-
• 3-(m-Hydroxyphenyl)propionic acid
• 3-Hydroxyphenylpropionic acid
• 3-Hydroxybenzenepropanoic acid
• Dihydro-m-coumaric acid
• NSC 33135
• NSC 39468

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[327.77; 378.62]	J/mol×K	[658.33; 891.69]
Cp,gas	327.77	J/mol×K	658.33	Joback Calculated Property
Cp,gas	337.69	J/mol×K	697.22	Joback Calculated Property
Cp,gas	346.90	J/mol×K	736.12	Joback Calculated Property
Cp,gas	355.50	J/mol×K	775.01	Joback Calculated Property
Cp,gas	363.59	J/mol×K	813.90	Joback Calculated Property
Cp,gas	371.26	J/mol×K	852.80	Joback Calculated Property
Cp,gas	378.62	J/mol×K	891.69	Joback Calculated Property
η	[0.0000257; 0.0002657]	Pa×s	[489.93; 658.33]
η	0.0002657	Pa×s	489.93	Joback Calculated Property
η	0.0001620	Pa×s	518.00	Joback Calculated Property
η	0.0001040	Pa×s	546.06	Joback Calculated Property
η	0.0000697	Pa×s	574.13	Joback Calculated Property
η	0.0000484	Pa×s	602.20	Joback Calculated Property
η	0.0000348	Pa×s	630.26	Joback Calculated Property
η	0.0000257	Pa×s	658.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-(3-Hydroxyphenyl)propionic acid.

Sources

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

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