- InChI
- InChI=1S/C17H36O4Si2/c1-13(15(19)21-23(10,11)17(5,6)7)12-14(18)20-22(8,9)16(2,3)4/h13H,12H2,1-11H3
- InChI Key
- RMDDLEXHNWAQGQ-UHFFFAOYSA-N
- Formula
- C17H36O4Si2
- SMILES
-
CC(CC(=O)O[Si](C)(C)C(C)(C)C)C
(=O)O[Si](C)(C)C(C)(C)C - Molecular Weight1
- 360.64
- CAS
- 98830-33-2
- Other Names
-
- Methylsuccinic acid, bis-TBDMS
- Methylsuccinic acid, bis(tert-butyldimethylsilyl) ester
- Methylsuccinic acid, diTBDMS
- Methylsuccinic acid, bis-TBDMS ester
- Methylsuccinic acid, TBDMS
- Methylsuccinic acid, DMTBS
- Bis[tert-butyl(dimethyl)silyl] 2-methylsuccinate
- Methylsuccinic 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 | 0.6868 | Relay (1.0) Calculated Property | |
| ΔfG° | -384.05 | kJ/mol | Relay (1.0-beta) Calculated Property ⚠️ |
| ΔfH°gas | -1200.82 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 67.64 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.28 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.109 | Crippen Calculated Property | |
| Pc | 1410.42 | kPa | Relay (1.0-beta) Calculated Property ⚠️ |
| Inp | [1755.00; 1770.00] |
|
|
| Inp | 1770.00 | NIST | |
| Inp | 1759.10 | NIST | |
| Inp | 1766.00 | NIST | |
| Inp | 1769.00 | NIST | |
| Inp | 1755.00 | NIST | |
| Inp | 1759.10 | NIST | |
| Tboil | 522.98 | K | Relay (1.0) Calculated Property |
| Tc | 754.44 | K | Relay (1.0) Calculated Property |
| Tfus | 343.30 | K | Relay (1.0) Calculated Property |
| Vc | 1.196 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Butanedioic acid, methyl-, 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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