- InChI
- InChI=1S/C22H46O4Si2/c1-21(2,3)27(7,8)25-19(23)17-15-13-11-12-14-16-18-20(24)26-28(9,10)22(4,5)6/h11-18H2,1-10H3
- InChI Key
- XANNRUSHAVBUKW-UHFFFAOYSA-N
- Formula
- C22H46O4Si2
- SMILES
-
CC(C)(C)[Si](C)(C)OC(=O)CCCCCC
CCC(=O)O[Si](C)(C)C(C)(C)C - Molecular Weight1
- 430.77
- CAS
- 104255-98-3
- Other Names
-
- Sebacic acid, bis(tert-butyldimethylsilyl) ester
- Sebacic acid, diTBDMS
- Sebacic acid, DMTBS
- Sebacic acid, TBDMS
- Bis[tert-butyl(dimethyl)silyl] sebacate
- Sebacic acid, 2tbdms derivative
- 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 | 0.9401 | Relay (1.0) Calculated Property | |
| ΔfG° | -325.93 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1294.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 85.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.19 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.204 | Crippen Calculated Property | |
| Pc | 995.31 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2366.70; 2378.00] |
|
|
| Inp | 2378.00 | NIST | |
| Inp | 2366.70 | NIST | |
| Inp | 2372.00 | NIST | |
| Inp | 2377.00 | NIST | |
| Inp | 2372.00 | NIST | |
| Inp | 2366.70 | NIST | |
| Inp | 2378.00 | NIST | |
| Tboil | 590.05 | K | Relay (1.0) Calculated Property |
| Tc | 807.54 | K | Relay (1.0) Calculated Property |
| Tfus | 344.39 | K | Relay (1.0) Calculated Property |
| Vc | 1.486 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Decanedioic acid, bis(tert-butyldimethylsilyl) ester.
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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