- InChI
- InChI=1S/C15H26OSi/c1-4-12-17(13-5-2,14-6-3)16-15-10-8-7-9-11-15/h7-11H,4-6,12-14H2,1-3H3
- InChI Key
- CHVZRUTUEJALOM-UHFFFAOYSA-N
- Formula
- C15H26OSi
- SMILES
- CCC[Si](CCC)(CCC)Oc1ccccc1
- Molecular Weight1
- 250.45
- CAS
- 17902-83-9
- 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 | 0.5981 | Relay (1.0) Calculated Property | |
| ΔfG° | 57.61 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -289.54 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 61.04 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.66 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.241 | Crippen Calculated Property | |
| Pc | 1870.44 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1604.10 | NIST | |
| Tboil | 550.38 | K | Relay (1.0) Calculated Property |
| Tc | 742.60 | K | Relay (1.0) Calculated Property |
| Tfus | 241.19 | K | Relay (1.0) Calculated Property |
| Vc | 0.809 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
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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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