- InChI
- InChI=1S/C26H40O7Si/c1-15-11-25-12-16(15)9-10-18(25)26(23(29)32-5)14-17(33-34(6,7)8)13-24(2,22(28)31-4)20(26)19(25)21(27)30-3/h16-20H,1,9-14H2,2-8H3/t16-,17-,18?,19-,20?,24-,25+,26-/m0/s1
- InChI Key
- ZVOYSZVAQICPHG-BENBUWORSA-N
- Formula
- C26H40O7Si
- SMILES
-
C=C1CC23CC1CCC2C1(C(=O)OC)CC(O
[Si](C)(C)C)CC(C)(C(=O)OC)C1C3 C(=O)OC - Molecular Weight1
- 492.68
- Other Names
-
- GA46, MeTMS
- 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 | 0.7125 | Relay (1.0) Calculated Property | |
| ΔfG° | -413.78 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1336.10 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 119.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.04 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.69 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.121 | Crippen Calculated Property | |
| Pc | 308.25 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2604.00; 2616.00] |
|
|
| Inp | 2604.00 | NIST | |
| Inp | 2616.00 | NIST | |
| Tboil | 681.33 | K | Relay (1.0) Calculated Property |
| Tc | 961.36 | K | Relay (1.0) Calculated Property |
| Tfus | 372.54 | K | Relay (1.0) Calculated Property |
| Vc | 1.381 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to GA46 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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