- InChI
- InChI=1S/C27H44O2Si2/c1-9-30(5,6)28-21-15-17-26(3)20(19-21)11-12-22-23-13-14-25(29-31(7,8)10-2)27(23,4)18-16-24(22)26/h9-11,14,21-24H,1-2,12-13,15-19H2,3-8H3/t21-,22?,23?,24?,26-,27-/m1/s1
- InChI Key
- GDDOJLVQBHTFEF-URKQOXIASA-N
- Formula
- C27H44O2Si2
- SMILES
-
C=C[Si](C)(C)OC1=CCC2C3CC=C4CC
(O[Si](C)(C)C=C)CCC4(C)C3CCC12 C - Molecular Weight1
- 456.81
- 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).
- 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 | 0.5291 | Relay (... Calculated Property | |
| ΔfG° | 252.09 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -493.22 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 106.20 | kJ/mol | Relay (... Calculated Property |
| IE | 8.62 | eV | Relay (... Calculated Property |
| log10WS | -5.86 | Relay (... Calculated Property | |
| logPoct/wat | 7.705 | Crippen Calculated Property | |
| Pc | 217.31 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 665.50 | K | Relay (... Calculated Property |
| Tc | 930.91 | K | Relay (... Calculated Property |
| Tfus | 349.96 | K | Relay (... Calculated Property |
| Vc | 1.410 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 5-Androsten-3«beta»-ol-17-one, VDMS.
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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