- InChI
- InChI=1S/C17H26O4Si/c1-17(2,3)22(6,7)21-16(18)11-9-13-8-10-14(19-4)12-15(13)20-5/h8-12H,1-7H3/b11-9+
- InChI Key
- BQAREBFODUFEEV-PKNBQFBNSA-N
- Formula
- C17H26O4Si
- SMILES
-
COc1ccc(C=CC(=O)O[Si](C)(C)C(C
)(C)C)c(OC)c1 - Molecular Weight1
- 322.47
- Other Names
-
- 2,4-Dimethoxycinnamic acid, (e)-, 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 | 0.7258 | Relay (1.0) Calculated Property | |
| ΔfG° | -216.01 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -746.67 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 83.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.265 | Crippen Calculated Property | |
| Pc | 1516.45 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2307.50 | NIST | |
| Tboil | 608.49 | K | Relay (1.0) Calculated Property |
| Tc | 818.37 | K | Relay (1.0) Calculated Property |
| Tfus | 368.44 | K | Relay (1.0) Calculated Property |
| Vc | 0.941 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to trans-2,4-Dimethoxycinnamic 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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