- InChI
- InChI=1S/C15H24O3Si/c1-11(16)14-12(17-5)9-8-10-13(14)18-19(6,7)15(2,3)4/h8-10H,1-7H3
- InChI Key
- WAGOHTPSDQWMKF-UHFFFAOYSA-N
- Formula
- C15H24O3Si
- SMILES
-
COc1cccc(O[Si](C)(C)C(C)(C)C)c
1C(C)=O - Molecular Weight1
- 280.43
- Other Names
-
- 2'-Hydroxy-6'-methoxyacetophenone, 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 | 0.6345 | Relay (... Calculated Property | |
| ΔfG° | -170.29 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -622.62 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 67.69 | kJ/mol | Relay (... Calculated Property |
| IE | 8.25 | eV | Relay (... Calculated Property |
| log10WS | -3.52 | Relay (... Calculated Property | |
| logPoct/wat | 4.282 | Crippen Calculated Property | |
| Pc | 1710.23 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1763.40; 1763.40] |
|
|
| Inp | 1763.40 | NIST | |
| Inp | 1763.40 | NIST | |
| Tboil | 580.28 | K | Relay (... Calculated Property |
| Tc | 799.45 | K | Relay (... Calculated Property |
| Tfus | 344.99 | K | Relay (... Calculated Property |
| Vc | 0.853 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2'-Hydroxy-6'-methoxyacetophenone, tert-butyldimethylsilyl 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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