![[13C]endo-GA34 methyl ester TMS ether](/cid/65-729-1/13C-endo-GA34-methyl-ester-TMS-ether.png "[13C]endo-GA34 methyl ester TMS ether")
- InChI
- InChI=1S/C26H42O6Si2/c1-15-12-25-13-16(15)10-11-18(25)26-14-17(31-33(4,5)6)21(32-34(7,8)9)24(2,23(28)30-26)20(26)19(25)22(27)29-3/h16-21H,1,10-14H2,2-9H3/t16?,17-,18+,19+,20+,21-,24-,25-,26+/m1/s1
- InChI Key
- MABXSEMQIJETIP-WKVIEWINSA-N
- Formula
- C26H42O6Si2
- SMILES
-
C=C1CC23CC1CCC2C12CC(O[Si](C)(
C)C)C(O[Si](C)(C)C)C(C)(C(=O)O 1)C2C3C(=O)OC - Molecular Weight1
- 506.78
- Other Names
-
- [14C1]GA34 methyl ester TMS ether
- 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 | 0.6713 | Relay (... Calculated Property | |
| ΔfG° | -399.58 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1240.99 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 111.97 | kJ/mol | Relay (... Calculated Property |
| IE | 9.08 | eV | Relay (... Calculated Property |
| log10WS | -4.27 | Relay (... Calculated Property | |
| logPoct/wat | 4.914 | Crippen Calculated Property | |
| Pc | 111.12 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2642.00; 2670.00] |
|
|
| Inp | 2659.00 | NIST | |
| Inp | 2670.00 | NIST | |
| Inp | 2644.00 | NIST | |
| Inp | 2642.00 | NIST | |
| Inp | 2659.00 | NIST | |
| Tboil | 691.07 | K | Relay (... Calculated Property |
| Tc | 975.64 | K | Relay (... Calculated Property |
| Tfus | 373.32 | K | Relay (... Calculated Property |
| Vc | 1.503 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to [13C]endo-GA34 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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