- InChI
- InChI=1S/C24H45NO4Si/c1-19(2)25-16-23(29-30(8,9)24(5,6)7)18-28-22-12-10-21(11-13-22)17-26-14-15-27-20(3)4/h10-13,19-20,23,25H,14-18H2,1-9H3
- InChI Key
- MIUUVROBIQDCOS-UHFFFAOYSA-N
- Formula
- C24H45NO4Si
- SMILES
-
CC(C)NCC(COc1ccc(COCCOC(C)C)cc
1)O[Si](C)(C)C(C)(C)C - Molecular Weight1
- 439.70
- 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 | 0.9149 | Relay (1.0) Calculated Property | |
| ΔfG° | -110.60 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -893.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 97.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.395 | Crippen Calculated Property | |
| Pc | 849.80 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2591.00; 2591.00] |
|
|
| Inp | 2591.00 | NIST | |
| Inp | 2591.00 | NIST | |
| Tboil | 669.83 | K | Relay (1.0) Calculated Property |
| Tc | 862.77 | K | Relay (1.0) Calculated Property |
| Tfus | 309.22 | K | Relay (1.0) Calculated Property |
| Vc | 1.393 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Bisoprolol, TBDMS.
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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