Chemical Properties of ethyl 2-hydroxy-3-phenylpropanoate

InChI

InChI=1S/C11H14O3/c1-2-14-11(13)10(12)8-9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3

InChI Key

HBOGUIFRIAXYNB-UHFFFAOYSA-N

Formula

C11H14O3

SMILES

CCOC(=O)C(O)Cc1ccccc1

Molecular Weight¹

194.23

Other Names

• Propanoic acid, 2-hydroxy-3-phenyl, ethyl ester
• ethyl phenyllactate

• 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.
• 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	0.6812		Relay (1.0) Calculated Property
ΔfH°gas	-516.22	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.22	kJ/mol	Joback Calculated Property
ΔvapH°	82.61	kJ/mol	Relay (1.0) Calculated Property
IE	9.02	eV	Relay (1.0) Calculated Property
log10WS	-1.04		Relay (1.0) Calculated Property
logPoct/wat	1.153		Crippen Calculated Property
McVol	155.400	ml/mol	McGowan Calculated Property
Pc	2960.12	kPa	Joback Calculated Property
Inp	[1438.00; 1460.00]
Inp	1445.00		NIST
Inp	1456.00		NIST
Inp	1456.00		NIST
Inp	1460.00		NIST
Inp	1456.00		NIST
Inp	1438.00		NIST
I	[2249.00; 2315.00]
I	2249.00		NIST
I	2273.00		NIST
I	2273.00		NIST
I	2315.00		NIST
I	2249.00		NIST
Tboil	542.24	K	Relay (1.0) Calculated Property
Tc	757.03	K	Relay (1.0) Calculated Property
Tfus	305.24	K	Relay (1.0) Calculated Property
Vc	0.569	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	[396.99; 459.87]	J/mol×K	[627.92; 825.36]
Cp,gas	396.99	J/mol×K	627.92	Joback Calculated Property
Cp,gas	409.30	J/mol×K	660.83	Joback Calculated Property
Cp,gas	420.86	J/mol×K	693.73	Joback Calculated Property
Cp,gas	431.67	J/mol×K	726.64	Joback Calculated Property
Cp,gas	441.76	J/mol×K	759.55	Joback Calculated Property
Cp,gas	451.16	J/mol×K	792.46	Joback Calculated Property
Cp,gas	459.87	J/mol×K	825.36	Joback Calculated Property
η	[0.0000518; 0.0087256]	Pa×s	[328.30; 627.92]
η	0.0087256	Pa×s	328.30	Joback Calculated Property
η	0.0021127	Pa×s	378.24	Joback Calculated Property
η	0.0007121	Pa×s	428.17	Joback Calculated Property
η	0.0003013	Pa×s	478.11	Joback Calculated Property
η	0.0001500	Pa×s	528.05	Joback Calculated Property
η	0.0000842	Pa×s	577.98	Joback Calculated Property
η	0.0000518	Pa×s	627.92	Joback Calculated Property

Similar Compounds

Find more compounds similar to ethyl 2-hydroxy-3-phenylpropanoate.

Sources

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

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