- InChI
- InChI=1S/C8H16N2O3/c1-5(2)10-7(11)4-3-6(9)8(12)13/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)
- InChI Key
- CABXGBMKSVRWOG-UHFFFAOYSA-N
- Formula
- C8H16N2O3
- SMILES
- CC(C)NC(=O)CCC(N)C(=O)O
- Molecular Weight1
- 188.22
- 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° | -227.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -509.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.87 | kJ/mol | Joback Calculated Property |
| log10WS | -0.89 | Crippen Calculated Property | |
| logPoct/wat | -0.297 | Crippen Calculated Property | |
| McVol | 152.550 | ml/mol | McGowan Calculated Property |
| Pc | 3534.66 | kPa | Joback Calculated Property |
| Tboil | 704.18 | K | Joback Calculated Property |
| Tc | 897.64 | K | Joback Calculated Property |
| Tfus | 446.52 | K | Joback Calculated Property |
| Vc | 0.567 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [429.76; 482.46] | J/mol×K | [704.18; 897.64] | 
|
| Cp,gas | 429.76 | J/mol×K | 704.18 | Joback Calculated Property |
| Cp,gas | 439.99 | J/mol×K | 736.42 | Joback Calculated Property |
| Cp,gas | 449.61 | J/mol×K | 768.67 | Joback Calculated Property |
| Cp,gas | 458.65 | J/mol×K | 800.91 | Joback Calculated Property |
| Cp,gas | 467.13 | J/mol×K | 833.15 | Joback Calculated Property |
| Cp,gas | 475.06 | J/mol×K | 865.40 | Joback Calculated Property |
| Cp,gas | 482.46 | J/mol×K | 897.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutamine, n-isopropyl-.
Sources
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