- InChI
- InChI=1S/C26H56OSi/c1-6-26(2)24-22-20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-23-25-27-28(3,4)5/h26H,6-25H2,1-5H3
- InChI Key
- WTWICDJQBLFZSU-UHFFFAOYSA-N
- Formula
- C26H56OSi
- SMILES
-
CCC(C)CCCCCCCCCCCCCCCCCCCO[Si]
(C)(C)C - Molecular Weight1
- 412.81
- 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 | 1.0519 | Relay (1.0) Calculated Property | |
| ΔfG° | 48.15 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -856.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 114.14 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.97 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.10 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.906 | Crippen Calculated Property | |
| Pc | 257.88 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2626.00; 2626.00] |
|
|
| Inp | 2626.00 | NIST | |
| Inp | 2626.00 | NIST | |
| Tboil | 629.53 | K | Relay (1.0) Calculated Property |
| Tc | 789.09 | K | Relay (1.0) Calculated Property |
| Tfus | 281.17 | K | Relay (1.0) Calculated Property |
| Vc | 1.595 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 1-Docosanol, 20-methyl, TMS.
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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