- InChI
- InChI=1S/C11H18OSi/c1-9-6-7-11(8-10(9)2)12-13(3,4)5/h6-8H,1-5H3
- InChI Key
- HUJKPJDYBJPESM-UHFFFAOYSA-N
- Formula
- C11H18OSi
- SMILES
- Cc1ccc(O[Si](C)(C)C)cc1C
- Molecular Weight1
- 194.35
- 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 | 0.4684 | Relay (... Calculated Property | |
| ΔfG° | 5.40 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -316.48 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 57.24 | kJ/mol | Relay (... Calculated Property |
| IE | 8.35 | eV | Relay (... Calculated Property |
| log10WS | -3.29 | Relay (... Calculated Property | |
| logPoct/wat | 3.517 | Crippen Calculated Property | |
| Pc | 1977.91 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1244.00; 1258.00] |
|
|
| Inp | 1244.00 | NIST | |
| Inp | 1258.00 | NIST | |
| Inp | 1258.00 | NIST | |
| Inp | 1244.00 | NIST | |
| Tboil | 500.23 | K | Relay (... Calculated Property |
| Tc | 683.33 | K | Relay (... Calculated Property |
| Tfus | 284.46 | K | Relay (... Calculated Property |
| Vc | 0.653 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 3,4-dimethyl, TMS.
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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