- InChI
- InChI=1S/C12H20OSi/c1-5-12(13-14(2,3)4)11-9-7-6-8-10-11/h6-10,12H,5H2,1-4H3
- InChI Key
- YLXOSLUBLGUGQW-UHFFFAOYSA-N
- Formula
- C12H20OSi
- SMILES
- CCC(O[Si](C)(C)C)c1ccccc1
- Molecular Weight1
- 208.37
- 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 | 0.4208 | Relay (1.0) Calculated Property | |
| ΔfG° | 38.23 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -310.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 60.72 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.27 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.989 | Crippen Calculated Property | |
| Pc | 1940.80 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1201.00 | NIST | |
| Tboil | 485.88 | K | Relay (1.0) Calculated Property |
| Tc | 679.78 | K | Relay (1.0) Calculated Property |
| Tfus | 251.08 | K | Relay (1.0) Calculated Property |
| Vc | 0.690 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propanol, 1-phenyl, 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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