- InChI
- InChI=1S/C28H52O6Si5/c1-13-27(25-21-17-15-18-22-25)29-35(3,4)31-37(7,8)33-39(11,12)34-38(9,10)32-36(5,6)30-28(14-2)26-23-19-16-20-24-26/h15-24,27-28H,13-14H2,1-12H3
- InChI Key
- UKQBJJRRJMNERZ-UHFFFAOYSA-N
- Formula
- C28H52O6Si5
- SMILES
-
CCC(O[Si](C)(C)O[Si](C)(C)O[Si
](C)(C)O[Si](C)(C)O[Si](C)(C)O C(CC)c1ccccc1)c1ccccc1 - Molecular Weight1
- 625.14
- Other Names
-
- 1,11-Di(1-phenylpropoxy)-2,2,4,4,6,6,8,8,10,10-decamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10-pentasilaundecane
- 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.
- 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 | 0.9261 | Relay (1.0) Calculated Property | |
| ΔfG° | -244.32 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1572.98 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 104.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.98 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.34 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.898 | Crippen Calculated Property | |
| Inp | 2556.00 | NIST | |
| Tboil | 679.28 | K | Relay (1.0) Calculated Property |
| Tc | 882.40 | K | Relay (1.0) Calculated Property |
| Tfus | 279.53 | K | Relay (1.0) Calculated Property |
| Vc | 2.024 | m3/kmol | Relay (1.0) 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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