- InChI
- InChI=1S/C27H51NO4/c1-6-8-9-10-11-12-13-14-15-19-31-26(29)24(16-7-2)28-27(30)32-25-20-22(5)17-18-23(25)21(3)4/h21-25H,6-20H2,1-5H3,(H,28,30)
- InChI Key
- WJWAZCKIUWOFRG-UHFFFAOYSA-N
- Formula
- C27H51NO4
- SMILES
-
CCCCCCCCCCCOC(=O)C(CCC)N=C(O)O
C1CC(C)CCC1C(C)C - Molecular Weight1
- 453.70
- 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 | 1.2210 | Relay (... Calculated Property | |
| ΔfG° | -204.38 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1173.36 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 137.15 | kJ/mol | Relay (... Calculated Property |
| IE | 8.94 | eV | Relay (... Calculated Property |
| log10WS | -6.74 | Relay (... Calculated Property | |
| logPoct/wat | 7.621 | Crippen Calculated Property | |
| McVol | 405.290 | ml/mol | McGowan Calculated Property |
| Pc | 757.23 | kPa | Joback Calculated Property |
| Inp | [2956.00; 2956.00] |
|
|
| Inp | 2956.00 | NIST | |
| Inp | 2956.00 | NIST | |
| Tboil | 673.67 | K | Relay (... Calculated Property |
| Tc | 892.27 | K | Relay (... Calculated Property |
| Tfus | 325.64 | K | Relay (... Calculated Property |
| Vc | 1.449 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to L-Norvaline, N-((1R)-(-)-menthyloxycarbonyl)-, undecyl 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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