- InChI
- InChI=1S/C13H26OSi/c1-8-13(4,14-15(5,6)7)11-9-10-12(2)3/h8,10H,1,9,11H2,2-7H3
- InChI Key
- GSRJPHNVKPGXHU-UHFFFAOYSA-N
- Formula
- C13H26OSi
- SMILES
- C=CC(C)(CCC=C(C)C)O[Si](C)(C)C
- Molecular Weight1
- 226.43
- Other Names
-
- Linalool, 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 | 0.4037 | Relay (... Calculated Property | |
| ΔfG° | 47.56 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -392.33 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 54.42 | kJ/mol | Relay (... Calculated Property |
| IE | 8.63 | eV | Relay (... Calculated Property |
| log10WS | -3.02 | Relay (... Calculated Property | |
| logPoct/wat | 4.529 | Crippen Calculated Property | |
| Pc | 1454.13 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1227.40; 1227.40] |
|
|
| Inp | 1227.40 | NIST | |
| Inp | 1227.40 | NIST | |
| Tboil | 484.69 | K | Relay (... Calculated Property |
| Tc | 629.77 | K | Relay (... Calculated Property |
| Tfus | 205.86 | K | Relay (... Calculated Property |
| Vc | 0.783 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Linalool, trimethylsilyl 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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