- InChI
- InChI=1S/C12H16Cl4OSi/c1-12(2,3)18(4,5)17-11-8(14)6-7(13)9(15)10(11)16/h6H,1-5H3
- InChI Key
- MDKIRIDRLGYYBR-UHFFFAOYSA-N
- Formula
- C12H16Cl4OSi
- SMILES
-
CC(C)(C)[Si](C)(C)Oc1c(Cl)cc(C
l)c(Cl)c1Cl - Molecular Weight1
- 346.15
- Other Names
-
- 2,3,4,6-tetrachlorophenol, TBDMS
- 2,3,4,6-Tetrachlorophenol, tbdms derivative
- 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 | 0.5367 | Relay (... Calculated Property | |
| ΔfG° | -63.57 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -366.77 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 71.14 | kJ/mol | Relay (... Calculated Property |
| IE | 8.49 | eV | Relay (... Calculated Property |
| log10WS | -6.05 | Relay (... Calculated Property | |
| logPoct/wat | 6.684 | Crippen Calculated Property | |
| Pc | 1879.72 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1991.40; 1991.40] |
|
|
| Inp | 1991.40 | NIST | |
| Inp | 1991.40 | NIST | |
| Tboil | 562.79 | K | Relay (... Calculated Property |
| Tc | 839.46 | K | Relay (... Calculated Property |
| Tfus | 380.13 | K | Relay (... Calculated Property |
| Vc | 0.847 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,4,6-Tetrachlorophenol, tert-butyldimethylsilyl 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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