- InChI
- InChI=1S/C14H19F3O2Si/c1-13(2,3)20(4,5)19-12(18)10-6-8-11(9-7-10)14(15,16)17/h6-9H,1-5H3
- InChI Key
- BXOAIFGVRSDJRE-UHFFFAOYSA-N
- Formula
- C14H19F3O2Si
- SMILES
-
CC(C)(C)[Si](C)(C)OC(=O)c1ccc(
C(F)(F)F)cc1 - Molecular Weight1
- 304.38
- 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 | 0.5807 | Relay (... Calculated Property | |
| ΔfG° | -659.23 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1155.84 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 66.99 | kJ/mol | Relay (... Calculated Property |
| IE | 9.68 | eV | Relay (... Calculated Property |
| log10WS | -4.35 | Relay (... Calculated Property | |
| logPoct/wat | 4.867 | Crippen Calculated Property | |
| Pc | 1657.05 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1439.00; 1439.00] |
|
|
| Inp | 1439.00 | NIST | |
| Inp | 1439.00 | NIST | |
| Tboil | 529.21 | K | Relay (... Calculated Property |
| Tc | 737.88 | K | Relay (... Calculated Property |
| Tfus | 352.95 | K | Relay (... Calculated Property |
| Vc | 0.805 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to tert-Butyldimethylsilyl 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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