- InChI
- InChI=1S/C21H35NO5Si/c1-8-14-25-19-12-10-11-13-20(19)26-16-18(27-28(5,6)7)15-22(17(3)4)21(23)24-9-2/h8,10-13,17-18H,1,9,14-16H2,2-7H3
- InChI Key
- QVZSZCOMZAZZGW-UHFFFAOYSA-N
- Formula
- C21H35NO5Si
- SMILES
-
C=CCOc1ccccc1OCC(CN(C(=O)OCC)C
(C)C)O[Si](C)(C)C - Molecular Weight1
- 409.59
- 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 | 0.8785 | Relay (1.0) Calculated Property | |
| ΔfG° | -181.19 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -951.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 104.69 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.90 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.717 | Crippen Calculated Property | |
| Pc | 675.47 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2276.10; 2276.10] |
|
|
| Inp | 2276.10 | NIST | |
| Inp | 2276.10 | NIST | |
| Tboil | 669.39 | K | Relay (1.0) Calculated Property |
| Tc | 829.15 | K | Relay (1.0) Calculated Property |
| Tfus | 302.63 | K | Relay (1.0) Calculated Property |
| Vc | 1.225 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Oxprenolol, N-ethoxycarbonylated, 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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