- InChI
- InChI=1S/C14H30O3Si2/c1-9-11-12(14(15)17-19(6,7)8)13(10-2)16-18(3,4)5/h9-11H2,1-8H3/b13-12-
- InChI Key
- SFBVEJZEAAGDNI-SEYXRHQNSA-N
- Formula
- C14H30O3Si2
- SMILES
-
CCCC(C(=O)O[Si](C)(C)C)=C(CC)O
[Si](C)(C)C - Molecular Weight1
- 302.56
- Other Names
-
- 3-Oxopentanoic acid, 2-propyl, TMS
- 2-Propyl-3-ketopentanoic acid, diTMS
- 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 | 0.6403 | Relay (... Calculated Property | |
| ΔfG° | -281.54 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -917.20 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 63.08 | kJ/mol | Relay (... Calculated Property |
| IE | 8.95 | eV | Relay (... Calculated Property |
| log10WS | -3.28 | Relay (... Calculated Property | |
| logPoct/wat | 4.680 | Crippen Calculated Property | |
| Pc | 972.00 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1419.00; 1437.00] |
|
|
| Inp | 1426.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Inp | 1437.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Inp | 1437.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Inp | 1426.00 | NIST | |
| Tboil | 527.36 | K | Relay (... Calculated Property |
| Tc | 685.05 | K | Relay (... Calculated Property |
| Tfus | 270.77 | K | Relay (... Calculated Property |
| Vc | 1.032 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2-n-Propyl-3-ketovalerate, bis(O-trimethylsilyl)- ..
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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