- InChI
- InChI=1S/C17H31NO4/c1-6-8-9-10-12-21-16(19)15(13-14(3)4)18(5)17(20)22-11-7-2/h7,14-15H,2,6,8-13H2,1,3-5H3
- InChI Key
- YFBQFCTUIXYZLV-UHFFFAOYSA-N
- Formula
- C17H31NO4
- SMILES
-
C=CCOC(=O)N(C)C(CC(C)C)C(=O)OC
CCCCC - Molecular Weight1
- 313.43
- 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° | -181.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -701.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.34 | kJ/mol | Joback Calculated Property |
| log10WS | -3.94 | Crippen Calculated Property | |
| logPoct/wat | 3.779 | Crippen Calculated Property | |
| McVol | 270.950 | ml/mol | McGowan Calculated Property |
| Pc | 1369.71 | kPa | Joback Calculated Property |
| Inp | 1919.00 | NIST | |
| Tboil | 749.18 | K | Joback Calculated Property |
| Tc | 931.07 | K | Joback Calculated Property |
| Tfus | 426.38 | K | Joback Calculated Property |
| Vc | 1.022 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [808.50; 896.70] | J/mol×K | [749.18; 931.07] | 
|
| Cp,gas | 808.50 | J/mol×K | 749.18 | Joback Calculated Property |
| Cp,gas | 825.48 | J/mol×K | 779.50 | Joback Calculated Property |
| Cp,gas | 841.52 | J/mol×K | 809.81 | Joback Calculated Property |
| Cp,gas | 856.64 | J/mol×K | 840.13 | Joback Calculated Property |
| Cp,gas | 870.86 | J/mol×K | 870.44 | Joback Calculated Property |
| Cp,gas | 884.21 | J/mol×K | 900.76 | Joback Calculated Property |
| Cp,gas | 896.70 | J/mol×K | 931.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, N-allyloxycarbonyl-N-methyl-, hexyl ester.
Sources
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