- InChI
- InChI=1S/C28H48O6Si2/c1-18-16-27-17-28(18,34-36(9,10)11)20(33-35(6,7)8)15-19(27)25(2)13-12-14-26(3,24(30)32-5)22(25)21(27)23(29)31-4/h19-22H,1,12-17H2,2-11H3/t19-,20+,21+,22-,25-,26+,27-,28-/m1/s1
- InChI Key
- KASWOOFZNVOGAL-ASNICIOVSA-N
- Formula
- C28H48O6Si2
- SMILES
-
C=C1CC23CC1(O[Si](C)(C)C)C(O[S
i](C)(C)C)CC2C1(C)CCCC(C)(C(=O )OC)C1C3C(=O)OC - Molecular Weight1
- 536.85
- 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 | 0.7239 | Relay (1.0) Calculated Property | |
| ΔfG° | -346.43 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1324.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 114.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.942 | Crippen Calculated Property | |
| Pc | 38.40 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2643.00; 2663.00] |
|
|
| Inp | 2662.00 | NIST | |
| Inp | 2663.00 | NIST | |
| Inp | 2643.00 | NIST | |
| Inp | 2643.00 | NIST | |
| Tboil | 680.02 | K | Relay (1.0) Calculated Property |
| Tc | 962.12 | K | Relay (1.0) Calculated Property |
| Tfus | 348.44 | K | Relay (1.0) Calculated Property |
| Vc | 1.614 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to GA127 methyl ester TMS ether.
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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