- InChI
- InChI=1S/C11H23NO3Si/c1-8-9(12-14-5)10(13)15-16(6,7)11(2,3)4/h8H2,1-7H3
- InChI Key
- TUQUTMXIZXCFDL-UHFFFAOYSA-N
- Formula
- C11H23NO3Si
- SMILES
-
CCC(=NOC)C(=O)O[Si](C)(C)C(C)(
C)C - Molecular Weight1
- 245.39
- 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 | 0.6214 | Relay (1.0) Calculated Property | |
| ΔfG° | -144.89 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -608.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 63.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.30 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.947 | Crippen Calculated Property | |
| Pc | 1786.70 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1306.00; 1306.00] |
|
|
| Inp | 1306.00 | NIST | |
| Inp | 1306.00 | NIST | |
| Tboil | 504.53 | K | Relay (1.0) Calculated Property |
| Tc | 691.76 | K | Relay (1.0) Calculated Property |
| Tfus | 298.90 | K | Relay (1.0) Calculated Property |
| Vc | 0.757 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Ketobutyric acid, MO TBDMS # 2.
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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