- InChI
- InChI=1S/C10H13NO2/c1-2-13-10(12)8-11-9-6-4-3-5-7-9/h3-7,11H,2,8H2,1H3
- InChI Key
- MLSGRWDEDYJNER-UHFFFAOYSA-N
- Formula
- C10H13NO2
- SMILES
- CCOC(=O)CNc1ccccc1
- Molecular Weight1
- 179.22
- CAS
- 2216-92-4
- Other Names
-
- Ethyl phenylglycinate
- Ethyl N-phenylglycinate
- N-Phenylglycine ethyl ester
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 1.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -204.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.72 | kJ/mol | Joback Calculated Property |
| log10WS | -1.60 | Crippen Calculated Property | |
| logPoct/wat | 1.662 | Crippen Calculated Property | |
| McVol | 145.420 | ml/mol | McGowan Calculated Property |
| Pc | 3127.99 | kPa | Joback Calculated Property |
| Tboil | 546.70 | K | NIST |
| Tc | 794.04 | K | Joback Calculated Property |
| Tfus | 353.70 | K | Joback Calculated Property |
| Vc | 0.546 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [348.22; 417.86] | J/mol×K | [581.34; 794.04] | 
|
| Cp,gas | 348.22 | J/mol×K | 581.34 | Joback Calculated Property |
| Cp,gas | 361.78 | J/mol×K | 616.79 | Joback Calculated Property |
| Cp,gas | 374.53 | J/mol×K | 652.24 | Joback Calculated Property |
| Cp,gas | 386.49 | J/mol×K | 687.69 | Joback Calculated Property |
| Cp,gas | 397.69 | J/mol×K | 723.14 | Joback Calculated Property |
| Cp,gas | 408.14 | J/mol×K | 758.59 | Joback Calculated Property |
| Cp,gas | 417.86 | J/mol×K | 794.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycine, N-phenyl-, ethyl ester.
Sources
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