- InChI
- InChI=1S/C24H42O2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(25)26-27(5,6)24(2,3)4/h7-10,13,16-22H2,1-6H3
- InChI Key
- ONEFLCFORGOXSV-UHFFFAOYSA-N
- Formula
- C24H42O2Si
- SMILES
-
CCCCCC#CCC#CCCCCCCCC(=O)O[Si](
C)(C)C(C)(C)C - Molecular Weight1
- 390.67
- 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 | 0.7974 | Relay (... Calculated Property | |
| ΔfG° | 122.06 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -434.02 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 97.12 | kJ/mol | Relay (... Calculated Property |
| IE | 8.96 | eV | Relay (... Calculated Property |
| log10WS | -6.34 | Relay (... Calculated Property | |
| logPoct/wat | 7.243 | Crippen Calculated Property | |
| Pc | 946.64 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 2557.90 | NIST | |
| Tboil | 596.90 | K | Relay (... Calculated Property |
| Tc | 824.14 | K | Relay (... Calculated Property |
| Tfus | 308.34 | K | Relay (... Calculated Property |
| Vc | 1.307 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 9,12-Octadecadiynoic acid, tert-butyldimethylsilyl ester.
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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