- InChI
- InChI=1S/C18H35NO4/c1-7-8-9-10-11-22-17(20)16(12-14(2)3)19(6)18(21)23-13-15(4)5/h14-16H,7-13H2,1-6H3
- InChI Key
- NCONFEOPVYGCRW-UHFFFAOYSA-N
- Formula
- C18H35NO4
- SMILES
-
CCCCCCOC(=O)C(CC(C)C)N(C)C(=O)
OCC(C)C - Molecular Weight1
- 329.47
- 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° | -263.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -852.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.85 | kJ/mol | Joback Calculated Property |
| log10WS | -4.26 | Crippen Calculated Property | |
| logPoct/wat | 4.249 | Crippen Calculated Property | |
| McVol | 289.340 | ml/mol | McGowan Calculated Property |
| Pc | 1246.85 | kPa | Joback Calculated Property |
| Tboil | 774.94 | K | Joback Calculated Property |
| Tc | 958.23 | K | Joback Calculated Property |
| Tfus | 424.41 | K | Joback Calculated Property |
| Vc | 1.091 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [893.48; 986.32] | J/mol×K | [774.94; 958.23] | 
|
| Cp,gas | 893.48 | J/mol×K | 774.94 | Joback Calculated Property |
| Cp,gas | 911.45 | J/mol×K | 805.49 | Joback Calculated Property |
| Cp,gas | 928.40 | J/mol×K | 836.04 | Joback Calculated Property |
| Cp,gas | 944.34 | J/mol×K | 866.58 | Joback Calculated Property |
| Cp,gas | 959.30 | J/mol×K | 897.13 | Joback Calculated Property |
| Cp,gas | 973.28 | J/mol×K | 927.68 | Joback Calculated Property |
| Cp,gas | 986.32 | J/mol×K | 958.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, N-isobutoxycarbonyl-N-methyl-, hexyl ester.
Sources
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