- InChI
- InChI=1S/C27H46O2Si/c1-25(2,3)30(16-6-7-17-30)29-24-11-10-22-21-9-8-19-18-20(28)12-14-26(19,4)23(21)13-15-27(22,24)5/h19,21-24H,6-18H2,1-5H3/t19?,21?,22?,23?,24-,26-,27-/m1/s1
- InChI Key
- IBNQAFJOZFRPBF-CJOKFZJGSA-N
- Formula
- C27H46O2Si
- SMILES
-
CC12CCC(=O)CC1CCC1C2CCC2(C)C(O
[Si]3(C(C)(C)C)CCCC3)CCC12 - Molecular Weight1
- 430.74
- 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 | 0.6079 | Relay (... Calculated Property | |
| ΔfG° | 68.34 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -662.57 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 109.07 | kJ/mol | Relay (... Calculated Property |
| IE | 8.38 | eV | Relay (... Calculated Property |
| log10WS | -6.26 | Relay (... Calculated Property | |
| logPoct/wat | 7.523 | Crippen Calculated Property | |
| Pc | 617.45 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [3154.00; 3222.00] |
|
|
| Inp | 3154.00 | NIST | |
| Inp | 3222.00 | NIST | |
| Inp | 3154.00 | NIST | |
| Tboil | 699.14 | K | Relay (... Calculated Property |
| Tc | 1010.20 | K | Relay (... Calculated Property |
| Tfus | 458.59 | K | Relay (... Calculated Property |
| Vc | 1.365 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Androstanolone, TMTBSi.
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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