- InChI
- InChI=1S/C17H38O5Si3/c1-23(2,3)20-15(14-17(19)22-25(7,8)9)12-10-11-13-16(18)21-24(4,5)6/h15H,10-14H2,1-9H3
- InChI Key
- GGRHSVIGEVXSML-UHFFFAOYSA-N
- Formula
- C17H38O5Si3
- SMILES
-
C[Si](C)(C)OC(=O)CCCCC(CC(=O)O
[Si](C)(C)C)O[Si](C)(C)C - Molecular Weight1
- 406.74
- 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 | 0.8391 | Relay (1.0) Calculated Property | |
| ΔfG° | -492.81 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1437.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 77.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.70 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.913 | Crippen Calculated Property | |
| Pc | 552.34 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2071.00; 2087.00] |
|
|
| Inp | 2087.00 | NIST | |
| Inp | Outlier 2071.00 | NIST | |
| Inp | 2086.00 | NIST | |
| Inp | 2083.00 | NIST | |
| Inp | 2083.00 | NIST | |
| Inp | 2083.00 | NIST | |
| Inp | 2087.00 | NIST | |
| Tboil | 559.30 | K | Relay (1.0) Calculated Property |
| Tc | 728.16 | K | Relay (1.0) Calculated Property |
| Tfus | 269.45 | K | Relay (1.0) Calculated Property |
| Vc | 1.354 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 3-Hydroxysebacic acid, tri-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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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.