- InChI
- InChI=1S/C15H31NO5Si/c1-10(2)9-20-14(19)16-12(11(3)17)13(18)21-22(7,8)15(4,5)6/h10-12,17H,9H2,1-8H3,(H,16,19)
- InChI Key
- YMFNBIUENIRVLY-UHFFFAOYSA-N
- Formula
- C15H31NO5Si
- SMILES
-
CC(C)COC(=O)NC(C(=O)O[Si](C)(C
)C(C)(C)C)C(C)O - Molecular Weight1
- 333.50
- 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 | 0.8555 | Relay (... Calculated Property | |
| ΔfG° | -458.81 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -1270.50 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 85.01 | kJ/mol | Relay (... Calculated Property |
| IE | 9.27 | eV | Relay (... Calculated Property |
| log10WS | -2.38 | Relay (... Calculated Property | |
| logPoct/wat | 2.666 | Crippen Calculated Property | |
| Pc | 1387.04 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1887.00; 1887.00] |
|
|
| Inp | 1887.00 | NIST | |
| Inp | 1887.00 | NIST | |
| Tboil | 567.11 | K | Relay (... Calculated Property |
| Tc | 784.02 | K | Relay (... Calculated Property |
| Tfus | 357.04 | K | Relay (... Calculated Property |
| Vc | 1.008 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Thr isoBOC TBDMS #1.
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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