- InChI
- InChI=1S/C22H34O4Si/c1-14(2)10-12-22(13-11-15(3)4)20(24)17(18(23)16(5)6)19(21(22)25)26-27(7,8)9/h10-11,16H,12-13H2,1-9H3
- InChI Key
- BPJDNHJLOXBFDH-UHFFFAOYSA-N
- Formula
- C22H34O4Si
- SMILES
-
CC(C)=CCC1(CC=C(C)C)C(=O)C(O[S
i](C)(C)C)=C(C(=O)C(C)C)C1=O - Molecular Weight1
- 390.59
- 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 | 0.6623 | Relay (1.0) Calculated Property | |
| ΔfG° | -272.98 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -784.54 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 79.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.25 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.15 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.168 | Crippen Calculated Property | |
| Pc | 481.28 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2039.00 | NIST | |
| Tboil | 595.50 | K | Relay (1.0) Calculated Property |
| Tc | 818.42 | K | Relay (1.0) Calculated Property |
| Tfus | 353.50 | K | Relay (1.0) Calculated Property |
| Vc | 1.173 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Cohulupone, 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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