- InChI
- InChI=1S/C13H20OSi/c1-5-12(2)14-15(3,4)11-13-9-7-6-8-10-13/h5-10,12H,1,11H2,2-4H3
- InChI Key
- PFISSPOQQCLXTQ-UHFFFAOYSA-N
- Formula
- C13H20OSi
- SMILES
- C=CC(C)O[Si](C)(C)Cc1ccccc1
- Molecular Weight1
- 220.38
- 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 | 0.4139 | Relay (1.0) Calculated Property | |
| ΔfG° | 123.20 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -220.52 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 61.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.01 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.564 | Crippen Calculated Property | |
| Pc | 1901.82 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1351.00 | NIST | |
| Tboil | 513.40 | K | Relay (1.0) Calculated Property |
| Tc | 692.33 | K | Relay (1.0) Calculated Property |
| Tfus | 239.04 | K | Relay (1.0) Calculated Property |
| Vc | 0.703 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 3-Buten-2-ol, benzyldimethylsilyl 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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