- InChI
- InChI=1S/C13H24O2Si2/c1-11-9-8-10-12(14-16(2,3)4)13(11)15-17(5,6)7/h8-10H,1-7H3
- InChI Key
- INBPVSVUSZJONB-UHFFFAOYSA-N
- Formula
- C13H24O2Si2
- SMILES
-
Cc1cccc(O[Si](C)(C)C)c1O[Si](C
)(C)C - Molecular Weight1
- 268.50
- Other Names
-
- 3-Methyl1,2-dihydroxybenzene, TMS
- 3-Methylcatechol, 2tms 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 | 0.5548 | Relay (... Calculated Property | |
| ΔfG° | -77.14 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -571.31 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 60.91 | kJ/mol | Relay (... Calculated Property |
| IE | 8.62 | eV | Relay (... Calculated Property |
| log10WS | -3.30 | Relay (... Calculated Property | |
| logPoct/wat | 4.422 | Crippen Calculated Property | |
| Pc | 1317.38 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1398.50; 1403.00] |
|
|
| Inp | 1398.50 | NIST | |
| Inp | 1403.00 | NIST | |
| Inp | 1403.00 | NIST | |
| Inp | 1398.50 | NIST | |
| Tboil | 524.86 | K | Relay (... Calculated Property |
| Tc | 717.67 | K | Relay (... Calculated Property |
| Tfus | 300.93 | K | Relay (... Calculated Property |
| Vc | 0.900 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methylcatechol, bis(trimethylsilyl) 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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