- InChI
- InChI=1S/C12H31NO2Si3/c1-11(12(14)15-18(8,9)10)13(16(2,3)4)17(5,6)7/h11H,1-10H3
- InChI Key
- JDPKWBHZDCBTPK-UHFFFAOYSA-N
- Formula
- C12H31NO2Si3
- SMILES
-
CC(C(=O)O[Si](C)(C)C)N([Si](C)
(C)C)[Si](C)(C)C - Molecular Weight1
- 305.64
- 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 | 0.5092 | Relay (1.0) Calculated Property | |
| ΔfG° | -101.81 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -793.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 55.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.31 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.56 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.725 | Crippen Calculated Property | |
| Pc | 975.17 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1361.00 | NIST | |
| Tboil | 483.87 | K | Relay (1.0) Calculated Property |
| Tc | 666.12 | K | Relay (1.0) Calculated Property |
| Tfus | 281.41 | K | Relay (1.0) Calculated Property |
| Vc | 1.026 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Alanine, 3TMS.
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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