- InChI
- InChI=1S/C23H43NO4/c1-6-8-9-10-11-15-27-22(25)20(12-7-2)24-23(26)28-21-16-18(5)13-14-19(21)17(3)4/h17-21H,6-16H2,1-5H3,(H,24,26)
- InChI Key
- WFNQHAMIRRPNNU-UHFFFAOYSA-N
- Formula
- C23H43NO4
- SMILES
-
CCCCCCCOC(=O)C(CCC)N=C(O)OC1CC
(C)CCC1C(C)C - Molecular Weight1
- 397.59
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 1.0768 | Relay (... Calculated Property | |
| ΔfG° | -237.36 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1093.09 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 121.19 | kJ/mol | Relay (... Calculated Property |
| IE | 8.81 | eV | Relay (... Calculated Property |
| log10WS | -5.48 | Relay (... Calculated Property | |
| logPoct/wat | 6.060 | Crippen Calculated Property | |
| McVol | 348.930 | ml/mol | McGowan Calculated Property |
| Pc | 946.75 | kPa | Joback Calculated Property |
| Inp | [2555.00; 2555.00] |
|
|
| Inp | 2555.00 | NIST | |
| Inp | 2555.00 | NIST | |
| Tboil | 645.84 | K | Relay (... Calculated Property |
| Tc | 859.70 | K | Relay (... Calculated Property |
| Tfus | 313.93 | K | Relay (... Calculated Property |
| Vc | 1.234 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to L-Norvaline, N-((1R)-(-)-menthyloxycarbonyl)-, heptyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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