- InChI
- InChI=1S/C12H15Cl3O3Si/c1-7(12(16)18-19(2,3)4)17-11-6-9(14)8(13)5-10(11)15/h5-7H,1-4H3
- InChI Key
- NQIWQVQFFUQDCC-UHFFFAOYSA-N
- Formula
- C12H15Cl3O3Si
- SMILES
-
CC(Oc1cc(Cl)c(Cl)cc1Cl)C(=O)O[
Si](C)(C)C - Molecular Weight1
- 341.69
- Other Names
-
- Trimethylsilylmethyl 2-(2,4,5-trichlorophenoxy)acetic acid, trimethylsilylmethyl ester
- 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 | 0.6277 | Relay (... Calculated Property | |
| ΔfG° | -350.82 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -709.39 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 84.49 | kJ/mol | Relay (... Calculated Property |
| IE | 8.68 | eV | Relay (... Calculated Property |
| log10WS | -4.61 | Relay (... Calculated Property | |
| logPoct/wat | 4.792 | Crippen Calculated Property | |
| Pc | 1545.62 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1858.00 | NIST | |
| Tboil | 562.17 | K | Relay (... Calculated Property |
| Tc | 799.65 | K | Relay (... Calculated Property |
| Tfus | 364.50 | K | Relay (... Calculated Property |
| Vc | 0.854 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Trimethylsilylmethyl 2-(2,4,5-trichlorophenoxy)acetate.
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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