- InChI
- InChI=1S/C16H17F3OSi/c1-21(2,11-12-6-4-3-5-7-12)20-10-13-14(17)8-9-15(18)16(13)19/h3-9H,10-11H2,1-2H3
- InChI Key
- QWZKPLWZAKPSSY-UHFFFAOYSA-N
- Formula
- C16H17F3OSi
- SMILES
-
C[Si](C)(Cc1ccccc1)OCc1c(F)ccc
(F)c1F - Molecular Weight1
- 310.39
- 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 | 0.5695 | Relay (1.0) Calculated Property | |
| ΔfG° | -304.99 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -625.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 82.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.608 | Crippen Calculated Property | |
| Pc | 1736.04 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1791.00; 1791.00] |
|
|
| Inp | 1791.00 | NIST | |
| Inp | 1791.00 | NIST | |
| Tboil | 582.02 | K | Relay (1.0) Calculated Property |
| Tc | 794.78 | K | Relay (1.0) Calculated Property |
| Tfus | 296.66 | K | Relay (1.0) Calculated Property |
| Vc | 0.829 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,6-Trifluorobenzyl alcohol, benzyldimethylsilyl ether.
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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