- InChI
- InChI=1S/C12H19NO2Si/c1-4-5-9-14-16(2,3)15-11-12-7-6-8-13-10-12/h4,6-8,10H,1,5,9,11H2,2-3H3
- InChI Key
- GDKAJKKYBCIGTI-UHFFFAOYSA-N
- Formula
- C12H19NO2Si
- SMILES
- C=CCCO[Si](C)(C)OCc1cccnc1
- Molecular Weight1
- 237.38
- ω : Acentric Factor.
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5185 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.893 | Crippen Calculated Property | |
| Pc | 1911.08 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1531.60; 1531.60] |
|
|
| Inp | 1531.60 | NIST | |
| Inp | 1531.60 | NIST | |
| Tboil | 538.51 | K | Relay (1.0) Calculated Property |
| Tc | 746.04 | K | Relay (1.0) Calculated Property |
| Tfus | 231.71 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Similar Compounds
Find more compounds similar to 3-Buten-1-ol, picolinyloxydimethylsilyl 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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