- InChI
- InChI=1S/C20H35NO4/c1-4-6-7-8-9-10-11-12-13-14-15-17-24-19(22)18(3)21-20(23)25-16-5-2/h2,18H,4,6-17H2,1,3H3,(H,21,23)
- InChI Key
- MZHDDJPJZGRJBZ-UHFFFAOYSA-N
- Formula
- C20H35NO4
- SMILES
-
C#CCOC(=O)NC(C)C(=O)OCCCCCCCCC
CCCC - Molecular Weight1
- 353.50
- 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° | -40.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -605.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.33 | kJ/mol | Joback Calculated Property |
| log10WS | -5.99 | Crippen Calculated Property | |
| logPoct/wat | 4.589 | Crippen Calculated Property | |
| McVol | 308.920 | ml/mol | McGowan Calculated Property |
| Pc | 1208.15 | kPa | Joback Calculated Property |
| Inp | 2432.00 | NIST | |
| Tboil | 849.43 | K | Joback Calculated Property |
| Tc | 1042.93 | K | Joback Calculated Property |
| Tfus | 544.11 | K | Joback Calculated Property |
| Vc | 1.194 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [976.56; 1061.70] | J/mol×K | [849.43; 1042.93] | 
|
| Cp,gas | 976.56 | J/mol×K | 849.43 | Joback Calculated Property |
| Cp,gas | 993.34 | J/mol×K | 881.68 | Joback Calculated Property |
| Cp,gas | 1009.05 | J/mol×K | 913.93 | Joback Calculated Property |
| Cp,gas | 1023.72 | J/mol×K | 946.18 | Joback Calculated Property |
| Cp,gas | 1037.36 | J/mol×K | 978.43 | Joback Calculated Property |
| Cp,gas | 1050.01 | J/mol×K | 1010.68 | Joback Calculated Property |
| Cp,gas | 1061.70 | J/mol×K | 1042.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to D-Alanine, N-propargyloxycarbonyl-, tridecyl ester.
Sources
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