- InChI
- InChI=1S/C24H41NO5Si/c1-7-28-24(26)25(19(2)3)16-23(30-31(4,5)6)18-29-22-12-10-20(11-13-22)14-15-27-17-21-8-9-21/h10-13,19,21,23H,7-9,14-18H2,1-6H3
- InChI Key
- MWKFMDDLKAINHT-UHFFFAOYSA-N
- Formula
- C24H41NO5Si
- SMILES
-
CCOC(=O)N(CC(COc1ccc(CCOCC2CC2
)cc1)O[Si](C)(C)C)C(C)C - Molecular Weight1
- 451.67
- 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 | 0.9985 | Relay (1.0) Calculated Property | |
| ΔfG° | -184.05 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1059.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 120.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.91 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.04 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.121 | Crippen Calculated Property | |
| Pc | 498.00 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2723.50 | NIST | |
| Tboil | 701.42 | K | Relay (1.0) Calculated Property |
| Tc | 888.40 | K | Relay (1.0) Calculated Property |
| Tfus | 296.21 | K | Relay (1.0) Calculated Property |
| Vc | 1.412 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Betaxolol, 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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