- InChI
- InChI=1S/C21H41NO4/c1-6-8-9-10-11-12-13-14-15-16-26-20(23)19(17-18(3)4)22(5)21(24)25-7-2/h18-19H,6-17H2,1-5H3
- InChI Key
- IIEFYFJXUPPNIO-UHFFFAOYSA-N
- Formula
- C21H41NO4
- SMILES
-
CCCCCCCCCCCOC(=O)C(CC(C)C)N(C)
C(=O)OCC - Molecular Weight1
- 371.55
- 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° | -236.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -909.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.92 | kJ/mol | Joback Calculated Property |
| log10WS | -5.76 | Crippen Calculated Property | |
| logPoct/wat | 5.563 | Crippen Calculated Property | |
| McVol | 331.610 | ml/mol | McGowan Calculated Property |
| Pc | 1022.04 | kPa | Joback Calculated Property |
| Inp | 2324.00 | NIST | |
| Tboil | 844.02 | K | Joback Calculated Property |
| Tc | 1034.17 | K | Joback Calculated Property |
| Tfus | 473.22 | K | Joback Calculated Property |
| Vc | 1.266 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1074.95; 1171.23] | J/mol×K | [844.02; 1034.17] | 
|
| Cp,gas | 1074.95 | J/mol×K | 844.02 | Joback Calculated Property |
| Cp,gas | 1093.87 | J/mol×K | 875.71 | Joback Calculated Property |
| Cp,gas | 1111.61 | J/mol×K | 907.40 | Joback Calculated Property |
| Cp,gas | 1128.18 | J/mol×K | 939.09 | Joback Calculated Property |
| Cp,gas | 1143.62 | J/mol×K | 970.78 | Joback Calculated Property |
| Cp,gas | 1157.96 | J/mol×K | 1002.48 | Joback Calculated Property |
| Cp,gas | 1171.23 | J/mol×K | 1034.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, N-ethoxycarbonyl-N-methyl-, undecyl ester.
Sources
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