- InChI
- InChI=1S/C29H50O7Si3/c1-17-14-28-15-18(17)13-19(34-37(4,5)6)22(28)29-16-20(35-38(7,8)9)24(36-39(10,11)12)27(2,26(31)33-29)23(29)21(28)25(30)32-3/h18-24H,1,13-16H2,2-12H3/t18-,19+,20+,21-,22?,23?,24+,27+,28-,29-/m0/s1
- InChI Key
- QVPGICUVUHIWGI-DZJDFXTKSA-N
- Formula
- C29H50O7Si3
- SMILES
-
C=C1CC23CC1CC(O[Si](C)(C)C)C2C
12CC(O[Si](C)(C)C)C(O[Si](C)(C )C)C(C)(C(=O)O1)C2C3C(=O)OC - Molecular Weight1
- 594.96
- 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 | 0.7520 | Relay (... Calculated Property | |
| ΔfG° | -477.80 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1531.82 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 113.69 | kJ/mol | Relay (... Calculated Property |
| IE | 8.98 | eV | Relay (... Calculated Property |
| log10WS | -4.45 | Relay (... Calculated Property | |
| logPoct/wat | 5.744 | Crippen Calculated Property | |
| Pc | -370.55 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 2847.00 | NIST | |
| Tboil | 711.05 | K | Relay (... Calculated Property |
| Tc | 999.89 | K | Relay (... Calculated Property |
| Tfus | 372.48 | K | Relay (... Calculated Property |
| Vc | 1.790 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to GA50, MeTMSi.
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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