- InChI
- InChI=1S/C22H45NO6Si2/c1-16(2)15-27-20(26)23-17(19(25)29-31(11,12)22(6,7)8)13-14-18(24)28-30(9,10)21(3,4)5/h16-17H,13-15H2,1-12H3,(H,23,26)
- InChI Key
- WTXLDKCRFHCTJL-UHFFFAOYSA-N
- Formula
- C22H45NO6Si2
- SMILES
-
CC(C)COC(=O)NC(CCC(=O)O[Si](C)
(C)C(C)(C)C)C(=O)O[Si](C)(C)C( C)(C)C - Molecular Weight1
- 475.77
- Other Names
-
- Glu, N-isoBOC TBDMS
- glutamic acid, N(O,S)-isoBOC TBDMS
- 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 | 0.9615 | Relay (... Calculated Property | |
| ΔfG° | -486.49 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1615.49 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 87.98 | kJ/mol | Relay (... Calculated Property |
| IE | 8.88 | eV | Relay (... Calculated Property |
| log10WS | -4.37 | Relay (... Calculated Property | |
| logPoct/wat | 5.614 | Crippen Calculated Property | |
| Pc | 898.34 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [2421.00; 2423.00] |
|
|
| Inp | 2422.90 | NIST | |
| Inp | 2423.00 | NIST | |
| Inp | 2421.00 | NIST | |
| Inp | 2422.90 | NIST | |
| Tboil | 617.50 | K | Relay (... Calculated Property |
| Tc | 843.83 | K | Relay (... Calculated Property |
| Tfus | 350.40 | K | Relay (... Calculated Property |
| Vc | 1.506 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Glu isoBOC TBDMS.
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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