- InChI
- InChI=1S/C23H45NO4/c1-6-8-9-10-11-12-13-14-15-16-18-27-22(25)21(19-20(3)4)24(5)23(26)28-17-7-2/h20-21H,6-19H2,1-5H3
- InChI Key
- MDXYJBPRJPUFEW-UHFFFAOYSA-N
- Formula
- C23H45NO4
- SMILES
-
CCCCCCCCCCCCOC(=O)C(CC(C)C)N(C
)C(=O)OCCC - Molecular Weight1
- 399.61
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.0761 | Relay (1.0) Calculated Property | |
| ΔfG° | -219.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1089.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.75 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.344 | Crippen Calculated Property | |
| McVol | 359.790 | ml/mol | McGowan Calculated Property |
| Pc | 907.24 | kPa | Joback Calculated Property |
| Inp | 2489.00 | NIST | |
| Tboil | 634.53 | K | Relay (1.0) Calculated Property |
| Tc | 809.76 | K | Relay (1.0) Calculated Property |
| Tfus | 271.23 | K | Relay (1.0) Calculated Property |
| Vc | 1.352 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1199.76; 1298.73] | J/mol×K | [889.78; 1089.53] | 
|
| Cp,gas | 1199.76 | J/mol×K | 889.78 | Joback Calculated Property |
| Cp,gas | 1219.52 | J/mol×K | 923.07 | Joback Calculated Property |
| Cp,gas | 1237.93 | J/mol×K | 956.36 | Joback Calculated Property |
| Cp,gas | 1255.02 | J/mol×K | 989.65 | Joback Calculated Property |
| Cp,gas | 1270.82 | J/mol×K | 1022.95 | Joback Calculated Property |
| Cp,gas | 1285.38 | J/mol×K | 1056.24 | Joback Calculated Property |
| Cp,gas | 1298.73 | J/mol×K | 1089.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, N-methyl-n-propoxycarbonyl-, dodecyl ester.
Sources
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