- InChI
- InChI=1S/C11H13F3O2Si/c1-17(2,3)16-10(15)8-4-6-9(7-5-8)11(12,13)14/h4-7H,1-3H3
- InChI Key
- PLSIFTZHOILBIK-UHFFFAOYSA-N
- Formula
- C11H13F3O2Si
- SMILES
-
C[Si](C)(C)OC(=O)c1ccc(C(F)(F)
F)cc1 - Molecular Weight1
- 262.30
- CAS
- 174579-97-6
- 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 | 0.5383 | Relay (... Calculated Property | |
| ΔfG° | -695.54 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1110.09 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 64.45 | kJ/mol | Relay (... Calculated Property |
| IE | 10.02 | eV | Relay (... Calculated Property |
| log10WS | -3.50 | Relay (... Calculated Property | |
| logPoct/wat | 3.697 | Crippen Calculated Property | |
| Pc | 1620.00 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1223.00; 1223.00] |
|
|
| Inp | 1223.00 | NIST | |
| Inp | 1223.00 | NIST | |
| Tboil | 495.55 | K | Relay (... Calculated Property |
| Tc | 674.91 | K | Relay (... Calculated Property |
| Tfus | 326.94 | K | Relay (... Calculated Property |
| Vc | 0.675 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Trimethylsilyl 4-(trifluoromethyl)benzoate.
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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