- InChI
- InChI=1S/C13H22N2Si/c1-16(2,3)15-9-8-11-10-14-13-7-5-4-6-12(11)13/h4-7,11,14-15H,8-10H2,1-3H3
- InChI Key
- JGMDTKGVMMVXDL-UHFFFAOYSA-N
- Formula
- C13H22N2Si
- SMILES
- C[Si](C)(C)NCCC1CNc2ccccc21
- Molecular Weight1
- 234.41
- 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 | 0.5414 | Relay (... Calculated Property | |
| ΔfG° | 298.61 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -82.69 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 80.94 | kJ/mol | Relay (... Calculated Property |
| IE | 7.61 | eV | Relay (... Calculated Property |
| log10WS | -1.93 | Relay (... Calculated Property | |
| logPoct/wat | 3.010 | Crippen Calculated Property | |
| Pc | 2056.85 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1875.00; 1875.00] |
|
|
| Inp | 1875.00 | NIST | |
| Inp | 1875.00 | NIST | |
| Tboil | 595.89 | K | Relay (... Calculated Property |
| Tc | 815.77 | K | Relay (... Calculated Property |
| Tfus | 347.38 | K | Relay (... Calculated Property |
| Vc | 0.740 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Tryptamine, mono-TMS.
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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