- InChI
- InChI=1S/C4H9NO2/c1-2-7-4(6)3-5/h2-3,5H2,1H3
- InChI Key
- NTNZTEQNFHNYBC-UHFFFAOYSA-N
- Formula
- C4H9NO2
- SMILES
- CCOC(=O)CN
- Molecular Weight1
- 103.12
- CAS
- 459-73-4
- Other Names
-
- (Ethoxycarbonyl)methylamine
- Ethyl 2-aminoacetate
- Ethyl aminoacetate
- Ethyl glycinate
- Ethyl glycine
- Aminoacetic acid, ethyl ester
- Glicine, ethyl ester
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.4772 | Relay (1.0) Calculated Property | |
| ΔfG° | -261.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -419.10 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.78 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.80 | eV | NIST |
| log10WS | 0.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.492 | Crippen Calculated Property | |
| McVol | 84.640 | ml/mol | McGowan Calculated Property |
| Pc | 4216.56 | kPa | Joback Calculated Property |
| Tboil | 421.89 | K | Relay (1.0) Calculated Property |
| Tc | 604.82 | K | Relay (1.0) Calculated Property |
| Tfus | 307.80 | K | Relay (1.0) Calculated Property |
| Vc | 0.310 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [127.05; 269.77] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 3.11520e+01 | |||
| Coefficient B | 3.90920e-01 | |||
| Coefficient C | -1.42600e-04 | |||
| Coefficient D | -9.70000e-09 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 127.05 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 151.17 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 173.30 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 193.41 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 211.46 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 227.42 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 241.26 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 252.95 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 262.47 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 269.77 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Glycine, ethyl ester.
Sources
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