Chemical Properties of L-(-)-2-HYDROXY-3-PHENYLPROPIONIC ACID

InChI

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

InChI Key

VOXXWSYKYCBWHO-UHFFFAOYSA-N

Formula

C9H10O3

SMILES

O=C(O)C(O)Cc1ccccc1

Molecular Weight¹

166.18

Other Names

• L-(-)-3-phenyllactic acid
• «alpha»-Hydroxyphenylpropanoic acid

• ω : Acentric Factor.
• 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).
• 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

Property	Value	Unit	Source
ω	0.7910		Relay (1.0) Calculated Property
ΔfH°gas	-488.42	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.82	kJ/mol	Joback Calculated Property
ΔvapH°	93.71	kJ/mol	Relay (1.0) Calculated Property
IE	9.15	eV	Relay (1.0) Calculated Property
log10WS	-0.28		Relay (1.0) Calculated Property
logPoct/wat	0.675		Crippen Calculated Property
McVol	127.220	ml/mol	McGowan Calculated Property
Pc	4098.62	kPa	Joback Calculated Property
Inp	[1545.00; 1545.00]
Inp	1545.00		NIST
Inp	1545.00		NIST
Tboil	548.74	K	Relay (1.0) Calculated Property
Tc	807.23	K	Relay (1.0) Calculated Property
Tfus	347.04	K	Relay (1.0) Calculated Property
Vc	0.457	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[329.12; 376.36]	J/mol×K	[669.45; 881.05]
Cp,gas	329.12	J/mol×K	669.45	Joback Calculated Property
Cp,gas	338.51	J/mol×K	704.72	Joback Calculated Property
Cp,gas	347.25	J/mol×K	739.98	Joback Calculated Property
Cp,gas	355.36	J/mol×K	775.25	Joback Calculated Property
Cp,gas	362.88	J/mol×K	810.52	Joback Calculated Property
Cp,gas	369.87	J/mol×K	845.79	Joback Calculated Property
Cp,gas	376.36	J/mol×K	881.05	Joback Calculated Property
η	[0.0000565; 0.0014067]	Pa×s	[424.03; 669.45]
η	0.0014067	Pa×s	424.03	Joback Calculated Property
η	0.0006504	Pa×s	464.93	Joback Calculated Property
η	0.0003407	Pa×s	505.84	Joback Calculated Property
η	0.0001966	Pa×s	546.74	Joback Calculated Property
η	0.0001225	Pa×s	587.64	Joback Calculated Property
η	0.0000811	Pa×s	628.55	Joback Calculated Property
η	0.0000565	Pa×s	669.45	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-(-)-2-HYDROXY-3-PHENYLPROPIONIC ACID.

Sources

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

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