Chemical Properties of ethyl 3-phenyl-DL-alaninate (CAS 1795-96-6)

InChI

InChI=1S/C11H15NO2/c1-3-14-11(13)9(2)12-10-7-5-4-6-8-10/h4-9,12H,3H2,1-2H3

InChI Key

FMFDWCAQDWISCD-UHFFFAOYSA-N

Formula

C11H15NO2

SMILES

CCOC(=O)C(C)Nc1ccccc1

Molecular Weight¹

193.24

CAS

1795-96-6

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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).
• 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	[396.75; 471.50]	J/mol×K	[603.78; 817.31]
Cp,gas	396.75	J/mol×K	603.78	Joback Calculated Property
Cp,gas	411.36	J/mol×K	639.37	Joback Calculated Property
Cp,gas	425.07	J/mol×K	674.96	Joback Calculated Property
Cp,gas	437.92	J/mol×K	710.54	Joback Calculated Property
Cp,gas	449.93	J/mol×K	746.13	Joback Calculated Property
Cp,gas	461.11	J/mol×K	781.72	Joback Calculated Property
Cp,gas	471.50	J/mol×K	817.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to ethyl 3-phenyl-DL-alaninate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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