- InChI
- InChI=1S/C12H9F11OSi/c1-25(2,24-3-11(19,20)10(18)12(21,22)23)9-7(16)5(14)4(13)6(15)8(9)17/h10H,3H2,1-2H3
- InChI Key
- QCZBNGGFWYVFHF-UHFFFAOYSA-N
- Formula
- C12H9F11OSi
- SMILES
-
C[Si](C)(OCC(F)(F)C(F)C(F)(F)F
)c1c(F)c(F)c(F)c(F)c1F - Molecular Weight1
- 406.27
- 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 | 0.6090 | Relay (... Calculated Property | |
| ΔfG° | -1835.98 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -2274.68 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 58.33 | kJ/mol | Relay (... Calculated Property |
| IE | 10.03 | eV | Relay (... Calculated Property |
| log10WS | -6.04 | Relay (... Calculated Property | |
| logPoct/wat | 4.347 | Crippen Calculated Property | |
| Pc | 1594.20 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1189.00; 1189.00] |
|
|
| Inp | 1189.00 | NIST | |
| Inp | 1189.00 | NIST | |
| Tboil | 466.06 | K | Relay (... Calculated Property |
| Tc | 619.62 | K | Relay (... Calculated Property |
| Tfus | 254.94 | K | Relay (... Calculated Property |
| Vc | 0.785 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2,2,3,4,4,4-Hexafluorobutanol, dimethylpentafluorophenylsilyl 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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