- InChI
- InChI=1S/C16H24O3Si/c1-16(2,3)20(5,6)19-15(17)12-11-13-9-7-8-10-14(13)18-4/h7-12H,1-6H3/b12-11+
- InChI Key
- QRVMYOKYDZQZBS-VAWYXSNFSA-N
- Formula
- C16H24O3Si
- SMILES
-
COc1ccccc1C=CC(=O)O[Si](C)(C)C
(C)(C)C - Molecular Weight1
- 292.45
- Other Names
-
- 2-Methoxycinnamic acid, tbdms derivative
- 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 | 0.6278 | Relay (1.0) Calculated Property | |
| ΔfG° | -117.61 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -594.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 77.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.257 | Crippen Calculated Property | |
| Pc | 1754.89 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2027.40 | NIST | |
| Tboil | 584.88 | K | Relay (1.0) Calculated Property |
| Tc | 797.17 | K | Relay (1.0) Calculated Property |
| Tfus | 355.63 | K | Relay (1.0) Calculated Property |
| Vc | 0.861 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methoxycinnamic acid, tert-butyldimethylsilyl ester.
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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