- InChI
- InChI=1S/C14H27NO4/c1-4-7-10-18-13(16)12(9-6-3)15-14(17)19-11-8-5-2/h12H,4-11H2,1-3H3,(H,15,17)
- InChI Key
- QUBRTDNTCALHPR-UHFFFAOYSA-N
- Formula
- C14H27NO4
- SMILES
- CCCCOC(=O)NC(CCC)C(=O)OCCCC
- Molecular Weight1
- 273.37
- 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).
- Inp : Non-polar retention indices.
- 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° | -313.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -773.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.12 | kJ/mol | Joback Calculated Property |
| log10WS | -3.69 | Crippen Calculated Property | |
| logPoct/wat | 3.025 | Crippen Calculated Property | |
| McVol | 232.980 | ml/mol | McGowan Calculated Property |
| Pc | 1667.33 | kPa | Joback Calculated Property |
| Inp | 1695.00 | NIST | |
| Tboil | 722.03 | K | Joback Calculated Property |
| Tc | 903.69 | K | Joback Calculated Property |
| Tfus | 429.52 | K | Joback Calculated Property |
| Vc | 0.896 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [681.45; 762.59] | J/mol×K | [722.03; 903.69] | 
|
| Cp,gas | 681.45 | J/mol×K | 722.03 | Joback Calculated Property |
| Cp,gas | 696.99 | J/mol×K | 752.31 | Joback Calculated Property |
| Cp,gas | 711.72 | J/mol×K | 782.58 | Joback Calculated Property |
| Cp,gas | 725.63 | J/mol×K | 812.86 | Joback Calculated Property |
| Cp,gas | 738.75 | J/mol×K | 843.13 | Joback Calculated Property |
| Cp,gas | 751.06 | J/mol×K | 873.41 | Joback Calculated Property |
| Cp,gas | 762.59 | J/mol×K | 903.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Norvaline, n-butoxycarbonyl-, butyl ester.
Sources
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