- InChI
- InChI=1S/C28H55NO4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32-26(30)25(22-24(2)3)29(7)27(31)33-23-28(4,5)6/h24-25H,8-23H2,1-7H3
- InChI Key
- GAVPSZMEXLQUAX-UHFFFAOYSA-N
- Formula
- C28H55NO4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)C(CC(C)C)
N(C)C(=O)OCC(C)(C)C - Molecular Weight1
- 469.74
- 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° | -174.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1062.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.21 | kJ/mol | Joback Calculated Property |
| log10WS | -8.44 | Crippen Calculated Property | |
| logPoct/wat | 8.150 | Crippen Calculated Property | |
| McVol | 430.240 | ml/mol | McGowan Calculated Property |
| Pc | 699.50 | kPa | Joback Calculated Property |
| Tboil | 1000.95 | K | Joback Calculated Property |
| Tc | 1236.28 | K | Joback Calculated Property |
| Tfus | 554.53 | K | Joback Calculated Property |
| Vc | 1.647 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1520.05; 1627.94] | J/mol×K | [1000.95; 1236.28] | 
|
| Cp,gas | 1520.05 | J/mol×K | 1000.95 | Joback Calculated Property |
| Cp,gas | 1542.17 | J/mol×K | 1040.17 | Joback Calculated Property |
| Cp,gas | 1562.50 | J/mol×K | 1079.39 | Joback Calculated Property |
| Cp,gas | 1581.13 | J/mol×K | 1118.61 | Joback Calculated Property |
| Cp,gas | 1598.17 | J/mol×K | 1157.83 | Joback Calculated Property |
| Cp,gas | 1613.74 | J/mol×K | 1197.06 | Joback Calculated Property |
| Cp,gas | 1627.94 | J/mol×K | 1236.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, N-neopentyloxycarbonyl-N-methyl-, pentadecyl ester.
Sources
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