- InChI
- InChI=1S/C21H44N2O6Si4/c1-30(2,3)25-15-16-18(28-32(7,8)9)19(29-33(10,11)12)20(26-16)23-14-13-17(22-21(23)24)27-31(4,5)6/h13-14,16,18-20H,15H2,1-12H3/t16-,18-,19?,20+/m0/s1
- InChI Key
- GQVVRBIFPVSHCQ-UDLHLFEOSA-N
- Formula
- C21H44N2O6Si4
- SMILES
-
C[Si](C)(C)OCC1OC(n2ccc(O[Si](
C)(C)C)nc2=O)C(O[Si](C)(C)C)C1 O[Si](C)(C)C - Molecular Weight1
- 532.93
- 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 | 0.8339 | Relay (1.0) Calculated Property | |
| ΔfG° | -296.73 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1456.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 104.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.646 | Crippen Calculated Property | |
| Pc | 1.56 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2332.00 | NIST | |
| Tboil | 678.21 | K | Relay (1.0) Calculated Property |
| Tc | 882.11 | K | Relay (1.0) Calculated Property |
| Tfus | 329.63 | K | Relay (1.0) Calculated Property |
| Vc | 1.668 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to «alpha»-Pseudouridine, 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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