- InChI
- InChI=1S/C21H40OSi/c1-4-5-6-7-8-9-10-11-12-13-17-20-22-23(2,3)21-18-15-14-16-19-21/h21H,4-12,14-16,18-20H2,1-3H3
- InChI Key
- JJSJTODYRSABQC-UHFFFAOYSA-N
- Formula
- C21H40OSi
- SMILES
-
CCCCCCCCCCC#CCO[Si](C)(C)C1CCC
CC1 - Molecular Weight1
- 336.63
- 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 | 0.6987 | Relay (... Calculated Property | |
| ΔfG° | 187.26 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -396.67 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 88.84 | kJ/mol | Relay (... Calculated Property |
| IE | 9.07 | eV | Relay (... Calculated Property |
| log10WS | -6.72 | Relay (... Calculated Property | |
| logPoct/wat | 7.077 | Crippen Calculated Property | |
| Pc | 989.85 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2253.00; 2253.00] |
|
|
| Inp | 2253.00 | NIST | |
| Inp | 2253.00 | NIST | |
| Tboil | 614.29 | K | Relay (... Calculated Property |
| Tc | 818.85 | K | Relay (... Calculated Property |
| Tfus | 256.08 | K | Relay (... Calculated Property |
| Vc | 1.143 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 1-Cyclohexyldimethylsilyloxytridec-2-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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