- InChI
- InChI=1S/C12H19NOSi/c1-10(13-15(2,3)4)12(14)11-8-6-5-7-9-11/h5-10,13H,1-4H3
- InChI Key
- VHQPJMOEFVVQOQ-UHFFFAOYSA-N
- Formula
- C12H19NOSi
- SMILES
- CC(N[Si](C)(C)C)C(=O)c1ccccc1
- Molecular Weight1
- 221.37
- Other Names
-
- Cathinone, tms 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 | 0.4778 | Relay (... Calculated Property | |
| ΔfG° | 87.31 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -253.47 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 69.35 | kJ/mol | Relay (... Calculated Property |
| IE | 8.48 | eV | Relay (... Calculated Property |
| log10WS | -1.94 | Relay (... Calculated Property | |
| logPoct/wat | 2.682 | Crippen Calculated Property | |
| Pc | 1819.86 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1474.30 | NIST | |
| Tboil | 531.65 | K | Relay (... Calculated Property |
| Tc | 745.46 | K | Relay (... Calculated Property |
| Tfus | 354.63 | K | Relay (... Calculated Property |
| Vc | 0.691 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to S(-)-Cathinone, N-trimethylsilyl-.
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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