- InChI
- InChI=1S/C18H31N3O6Si/c1-8-25-16(23)20-14(15(22)27-28(6,7)18(3,4)5)10-13-11-21(12-19-13)17(24)26-9-2/h11-12,14H,8-10H2,1-7H3,(H,20,23)
- InChI Key
- CHEOLGUBFQGKRO-UHFFFAOYSA-N
- Formula
- C18H31N3O6Si
- SMILES
-
CCOC(=O)NC(Cc1cn(C(=O)OCC)cn1)
C(=O)O[Si](C)(C)C(C)(C)C - Molecular Weight1
- 413.54
- 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 | 0.9594 | Relay (1.0) Calculated Property | |
| ΔfG° | -341.89 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1243.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 103.72 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.11 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.093 | Crippen Calculated Property | |
| Pc | 1109.80 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2504.00 | NIST | |
| Tboil | 630.80 | K | Relay (1.0) Calculated Property |
| Tc | 888.27 | K | Relay (1.0) Calculated Property |
| Tfus | 360.27 | K | Relay (1.0) Calculated Property |
| Vc | 1.178 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Histidine, ethoxycarbonylated, 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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