- InChI
- InChI=1S/C13H27NO5Si/c1-8-18-12(17)14-10(9(2)15)11(16)19-20(6,7)13(3,4)5/h9-10,15H,8H2,1-7H3,(H,14,17)
- InChI Key
- LDROHEUCALECQM-UHFFFAOYSA-N
- Formula
- C13H27NO5Si
- SMILES
-
CCOC(=O)NC(C(=O)O[Si](C)(C)C(C
)(C)C)C(C)O - Molecular Weight1
- 305.44
- 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 | 0.7999 | Relay (... Calculated Property | |
| ΔfG° | -476.50 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1216.76 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 84.58 | kJ/mol | Relay (... Calculated Property |
| IE | 9.33 | eV | Relay (... Calculated Property |
| log10WS | -1.75 | Relay (... Calculated Property | |
| logPoct/wat | 2.030 | Crippen Calculated Property | |
| Pc | 1564.87 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1745.00 | NIST | |
| Tboil | 551.57 | K | Relay (... Calculated Property |
| Tc | 769.35 | K | Relay (... Calculated Property |
| Tfus | 362.45 | K | Relay (... Calculated Property |
| Vc | 0.899 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Threonine, mono-ethoxycarbonylated, mono-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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