- InChI
- InChI=1S/C12H28O3Si2/c1-9-11(14-16(3,4)5)10(2)12(13)15-17(6,7)8/h10-11H,9H2,1-8H3
- InChI Key
- NYQQSMMILUJHAT-UHFFFAOYSA-N
- Formula
- C12H28O3Si2
- SMILES
-
CCC(O[Si](C)(C)C)C(C)C(=O)O[Si
](C)(C)C - Molecular Weight1
- 276.52
- Other Names
-
- 2-Methyl-3-hydroxyvaleric acid, di-TMS
- 2-Methyl-3-hydroxyvaleric acid, TMS
- Pentanoic acid, 2-methyl-3-trimethylsilyloxy, trimethylsilyl ester
- 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 | 0.5480 | Relay (1.0) Calculated Property | |
| ΔfG° | -342.64 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -940.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 58.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.63 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.631 | Crippen Calculated Property | |
| Pc | 1246.30 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1275.00; 1275.00] |
|
|
| Inp | 1275.00 | NIST | |
| Inp | 1275.00 | NIST | |
| Tboil | 480.85 | K | Relay (1.0) Calculated Property |
| Tc | 644.69 | K | Relay (1.0) Calculated Property |
| Tfus | 239.06 | K | Relay (1.0) Calculated Property |
| Vc | 0.925 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
![Butanoic acid, 2-methyl-3-[(trimethylsilyl)oxy]-, trimethylsilyl ester.](data:image/png;base64,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)
Find more compounds similar to 3-Trimethylsilyloxy-2-methyltrimethylsilylvalerate.
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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