- InChI
- InChI=1S/C9H21NO2Si/c1-6-7(2)8(10)9(11)12-13(3,4)5/h7-8H,6,10H2,1-5H3
- InChI Key
- ZBVUZZNOZGCJIE-UHFFFAOYSA-N
- Formula
- C9H21NO2Si
- SMILES
- CCC(C)C(N)C(=O)O[Si](C)(C)C
- Molecular Weight1
- 203.35
- Other Names
-
- L-isoleucine, tms derivative
- 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.
- 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 | 0.5251 | Relay (... Calculated Property | |
| ΔfG° | -198.07 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -669.25 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 59.70 | kJ/mol | Relay (... Calculated Property |
| IE | 8.64 | eV | Relay (... Calculated Property |
| log10WS | -1.82 | Relay (... Calculated Property | |
| logPoct/wat | 1.738 | Crippen Calculated Property | |
| Pc | 1830.26 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1178.60; 1178.60] |
|
|
| Inp | 1178.60 | NIST | |
| Inp | 1178.60 | NIST | |
| Tboil | 460.44 | K | Relay (... Calculated Property |
| Tc | 640.16 | K | Relay (... Calculated Property |
| Tfus | 294.92 | K | Relay (... Calculated Property |
| Vc | 0.655 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to l-Isoleucine, trimethylsilyl 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
- NIST Webbook
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