- InChI
- InChI=1S/C26H49NO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-30-25(28)24(21-5-2)27-26(29)31-22-6-3/h6,24H,3-5,7-23H2,1-2H3,(H,27,29)
- InChI Key
- VLJGJTNRUSFHBO-UHFFFAOYSA-N
- Formula
- C26H49NO4
- SMILES
-
C=CCOC(=O)NC(CCC)C(=O)OCCCCCCC
CCCCCCCCCC - Molecular Weight1
- 439.67
- 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).
- 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 | 1.2284 | Relay (1.0) Calculated Property | |
| ΔfG° | -125.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1084.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 68.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 128.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.36 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.482 | Crippen Calculated Property | |
| McVol | 397.760 | ml/mol | McGowan Calculated Property |
| Pc | 789.49 | kPa | Joback Calculated Property |
| Tboil | 670.25 | K | Relay (1.0) Calculated Property |
| Tc | 861.57 | K | Relay (1.0) Calculated Property |
| Tfus | 318.05 | K | Relay (1.0) Calculated Property |
| Vc | 1.475 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1381.02; 1476.91] | J/mol×K | [993.27; 1226.77] | 
|
| Cp,gas | 1381.02 | J/mol×K | 993.27 | Joback Calculated Property |
| Cp,gas | 1401.26 | J/mol×K | 1032.19 | Joback Calculated Property |
| Cp,gas | 1419.70 | J/mol×K | 1071.10 | Joback Calculated Property |
| Cp,gas | 1436.42 | J/mol×K | 1110.02 | Joback Calculated Property |
| Cp,gas | 1451.48 | J/mol×K | 1148.93 | Joback Calculated Property |
| Cp,gas | 1464.95 | J/mol×K | 1187.85 | Joback Calculated Property |
| Cp,gas | 1476.91 | J/mol×K | 1226.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Norvaline, N-allyoxycarbonyl-, heptadecyl ester.
Sources
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