- InChI
- InChI=1S/C8H18N2O3Si/c1-6(9)8(12)10-5-7(11)13-14(2,3)4/h6H,5,9H2,1-4H3,(H,10,12)
- InChI Key
- OIKROLCDGDKWOB-UHFFFAOYSA-N
- Formula
- C8H18N2O3Si
- SMILES
- CC(N)C(=O)NCC(=O)O[Si](C)(C)C
- Molecular Weight1
- 218.33
- Other Names
-
- Trimethylsilyl d-alanylglycinate
- Alanylglycine, tms 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 | 0.6222 | Relay (1.0) Calculated Property | |
| ΔfG° | -248.15 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -754.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 69.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.57 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.172 | Crippen Calculated Property | |
| Pc | 1922.08 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1515.00 | NIST | |
| Tboil | 519.53 | K | Relay (1.0) Calculated Property |
| Tc | 701.02 | K | Relay (1.0) Calculated Property |
| Tfus | 398.23 | K | Relay (1.0) Calculated Property |
| Vc | 0.656 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Ala-gly, trimethylsilyl 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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