- InChI
- InChI=1S/C27H54OSi/c1-7-11-15-18-22-29(23-19-16-12-8-2,24-20-17-13-9-3)28-27(21-14-10-4)25-26(5)6/h26-27H,7-13,15-20,22-25H2,1-6H3
- InChI Key
- YZXZGHIYLCGUGM-UHFFFAOYSA-N
- Formula
- C27H54OSi
- SMILES
-
CCC#CC(CC(C)C)O[Si](CCCCCC)(CC
CCCC)CCCCCC - Molecular Weight1
- 422.80
- 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 | 0.8943 | Relay (... Calculated Property | |
| ΔfG° | 166.72 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -503.70 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 86.76 | kJ/mol | Relay (... Calculated Property |
| IE | 8.67 | eV | Relay (... Calculated Property |
| log10WS | -7.92 | Relay (... Calculated Property | |
| logPoct/wat | 9.518 | Crippen Calculated Property | |
| Pc | 628.70 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2298.00; 2298.00] |
|
|
| Inp | 2298.00 | NIST | |
| Inp | 2298.00 | NIST | |
| Tboil | 627.78 | K | Relay (... Calculated Property |
| Tc | 809.51 | K | Relay (... Calculated Property |
| Tfus | 233.64 | K | Relay (... Calculated Property |
| Vc | 1.499 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-4-trihexylsilyloxyoct-5-yne.
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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