- InChI
- InChI=1S/C12H22O5Si/c1-12(2)15-9-8(17-18(3,4)5)7-6-13-11(14-7)10(9)16-12/h7-11H,6H2,1-5H3
- InChI Key
- GRMXOTBMTGNDCA-UHFFFAOYSA-N
- Formula
- C12H22O5Si
- SMILES
-
CC1(C)OC2C3OCC(O3)C(O[Si](C)(C
)C)C2O1 - Molecular Weight1
- 274.39
- 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 | 0.4789 | Relay (... Calculated Property | |
| ΔfG° | -389.89 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -965.14 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 71.31 | kJ/mol | Relay (... Calculated Property |
| IE | 9.33 | eV | Relay (... Calculated Property |
| log10WS | -2.14 | Relay (... Calculated Property | |
| logPoct/wat | 1.482 | Crippen Calculated Property | |
| Pc | 1537.20 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1523.40 | NIST | |
| Tboil | 560.34 | K | Relay (... Calculated Property |
| Tc | 760.87 | K | Relay (... Calculated Property |
| Tfus | 375.07 | K | Relay (... Calculated Property |
| Vc | 0.861 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
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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