- InChI
- InChI=1S/C25H42O3Si2/c1-24-14-13-18(27-29(3,4)5)15-17(24)9-10-19-20-11-12-22(28-30(6,7)8)25(20,2)16-21(26)23(19)24/h9,12,18-20,23H,10-11,13-16H2,1-8H3/t18-,19?,20?,23?,24-,25-/m1/s1
- InChI Key
- RHPKPJCDHHZWGF-MEMNOICKSA-N
- Formula
- C25H42O3Si2
- SMILES
-
CC12CC(=O)C3C(CC=C4CC(O[Si](C)
(C)C)CCC43C)C1CC=C2O[Si](C)(C) C - Molecular Weight1
- 446.77
- 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 | 0.5843 | Relay (... Calculated Property | |
| ΔfG° | 8.98 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -795.32 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 100.79 | kJ/mol | Relay (... Calculated Property |
| IE | 8.33 | eV | Relay (... Calculated Property |
| log10WS | -4.97 | Relay (... Calculated Property | |
| logPoct/wat | 6.694 | Crippen Calculated Property | |
| Pc | 267.73 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 2600.00 | NIST | |
| Tboil | 654.89 | K | Relay (... Calculated Property |
| Tc | 929.00 | K | Relay (... Calculated Property |
| Tfus | 407.11 | K | Relay (... Calculated Property |
| Vc | 1.389 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 3B-Hydroxy-androstan-5-en-17-one, enol, bis-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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