- InChI
- InChI=1S/C9H12Cl2OSi/c1-13(2,3)12-8-6-4-5-7(10)9(8)11/h4-6H,1-3H3
- InChI Key
- QAAZYQWMZYHYLZ-UHFFFAOYSA-N
- Formula
- C9H12Cl2OSi
- SMILES
- C[Si](C)(C)Oc1cccc(Cl)c1Cl
- Molecular Weight1
- 235.18
- CAS
- 67947-14-2
- Other Names
-
- 2,3-Dichlorophenol, trimethylsilyl ether
- Phenol, 2,3-dichloro, TMS
- 2,3-Dichlorophenol, tms 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 | 0.4374 | Relay (1.0) Calculated Property | |
| ΔfG° | -33.60 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -319.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 58.38 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.69 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.207 | Crippen Calculated Property | |
| Pc | 2146.81 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1371.00; 1405.00] |
|
|
| Inp | 1405.00 | NIST | |
| Inp | 1371.00 | NIST | |
| Inp | 1399.00 | NIST | |
| Tboil | 516.48 | K | Relay (1.0) Calculated Property |
| Tc | 731.59 | K | Relay (1.0) Calculated Property |
| Tfus | 291.36 | K | Relay (1.0) Calculated Property |
| Vc | 0.627 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Dichloro-3-trimethylsilyloxybenzene.
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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