- InChI
- InChI=1S/C18H42O6Si4/c1-25(2,3)20-13-14(22-26(4,5)6)15-16(23-27(7,8)9)17(18(19)21-15)24-28(10,11)12/h14-17H,13H2,1-12H3/t14?,15?,16-,17+/m1/s1
- InChI Key
- FTOCXQVQZOFUDF-BACDZXNISA-N
- Formula
- C18H42O6Si4
- SMILES
-
C[Si](C)(C)OCC(O[Si](C)(C)C)C1
OC(=O)C(O[Si](C)(C)C)C1O[Si](C )(C)C - Molecular Weight1
- 466.86
- CAS
- 55515-34-9
- Other Names
-
- Allonic acid, 1,4-lactone, (4TMS)-
- Allonic acid, 1,4-lactone, TMS
- Allonic acid, «gamma»-lactone, 4tms derivavative
- 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 | 0.7091 | Relay (... Calculated Property | |
| ΔfG° | -583.05 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1563.21 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 79.67 | kJ/mol | Relay (... Calculated Property |
| IE | 9.67 | eV | Relay (... Calculated Property |
| log10WS | -2.56 | Relay (... Calculated Property | |
| logPoct/wat | 4.424 | Crippen Calculated Property | |
| Pc | 329.49 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1962.00; 1962.00] |
|
|
| Inp | 1962.00 | NIST | |
| Inp | 1962.00 | NIST | |
| Tboil | 604.73 | K | Relay (... Calculated Property |
| Tc | 775.11 | K | Relay (... Calculated Property |
| Tfus | 324.85 | K | Relay (... Calculated Property |
| Vc | 1.510 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Allonic acid, 2,3,5,6-tetrakis-O-(trimethylsilyl)-, lactone.
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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