- InChI
- InChI=1S/C13H15F4NOSi/c1-20(2,6-4-3-5-18)19-8-9-7-10(14)12(16)13(17)11(9)15/h7H,3-4,6,8H2,1-2H3
- InChI Key
- OIRFPBQOHBFELD-UHFFFAOYSA-N
- Formula
- C13H15F4NOSi
- SMILES
-
C[Si](C)(CCCC#N)OCc1cc(F)c(F)c
(F)c1F - Molecular Weight1
- 305.34
- 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 | 0.6804 | Relay (... Calculated Property | |
| ΔfG° | -470.78 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -803.45 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 75.64 | kJ/mol | Relay (... Calculated Property |
| IE | 9.67 | eV | Relay (... Calculated Property |
| log10WS | -3.86 | Relay (... Calculated Property | |
| logPoct/wat | 4.268 | Crippen Calculated Property | |
| Pc | 1722.47 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1692.00; 1692.00] |
|
|
| Inp | 1692.00 | NIST | |
| Inp | 1692.00 | NIST | |
| Tboil | 548.71 | K | Relay (... Calculated Property |
| Tc | 750.02 | K | Relay (... Calculated Property |
| Tfus | 294.00 | K | Relay (... Calculated Property |
| Vc | 0.766 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,4,5-Tetrafluorobenzyl alcohol, (3-cyanopropyl)dimethylsilyl 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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