- InChI
- InChI=1S/C10H18O4Si/c1-8(11)7-9(12)5-6-10(13)14-15(2,3)4/h5-7H2,1-4H3
- InChI Key
- MBWXMISVSPVDBT-UHFFFAOYSA-N
- Formula
- C10H18O4Si
- SMILES
-
CC(=O)CC(=O)CCC(=O)O[Si](C)(C)
C - Molecular Weight1
- 230.33
- Other Names
-
- Trimethylsilyl 4,6-dioxoheptanoate
- 4,6-Dioxoheptanoic acid, 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 | 0.6072 | Relay (1.0) Calculated Property | |
| ΔfG° | -427.07 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -931.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 61.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.45 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.693 | Crippen Calculated Property | |
| Pc | 1799.92 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1416.50; 1416.50] |
|
|
| Inp | 1416.50 | NIST | |
| Inp | 1416.50 | NIST | |
| Tboil | 515.21 | K | Relay (1.0) Calculated Property |
| Tc | 689.86 | K | Relay (1.0) Calculated Property |
| Tfus | 308.60 | K | Relay (1.0) Calculated Property |
| Vc | 0.690 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 4,6-Dioxoheptanoic acid, 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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