- InChI
- InChI=1S/C10H19NO3Si/c1-8(2)6-9(12)11-7-10(13)14-15(3,4)5/h6H,7H2,1-5H3,(H,11,12)
- InChI Key
- CIBNSCXUKAEBGH-UHFFFAOYSA-N
- Formula
- C10H19NO3Si
- SMILES
-
CC(C)=CC(=O)NCC(=O)O[Si](C)(C)
C - Molecular Weight1
- 229.35
- CAS
- 54824-02-1
- Other Names
-
- 3-Methylcrotonylglycine, mono-TMS
- Glycine, N-(3-methyl-2-butenoyl), mono-TMS
- 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 | 0.6028 | Relay (1.0) Calculated Property | |
| ΔfG° | -236.74 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -714.35 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 68.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.01 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.96 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.447 | Crippen Calculated Property | |
| Pc | 1773.11 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1539.00; 1575.00] |
|
|
| Inp | 1564.00 | NIST | |
| Inp | 1562.00 | NIST | |
| Inp | 1575.00 | NIST | |
| Inp | 1539.00 | NIST | |
| Inp | 1539.00 | NIST | |
| Inp | 1539.00 | NIST | |
| Inp | 1539.00 | NIST | |
| Inp | 1564.00 | NIST | |
| Tboil | 526.51 | K | Relay (1.0) Calculated Property |
| Tc | 710.87 | K | Relay (1.0) Calculated Property |
| Tfus | 328.28 | K | Relay (1.0) Calculated Property |
| Vc | 0.704 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Glycine, N-(3-methyl-1-oxo-2-butenyl)-, 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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