- InChI
- InChI=1S/C17H36N2O2Si3/c1-14-17(21-24(8,9)10)16(12-19-22(2,3)4)15(11-18-14)13-20-23(5,6)7/h11,19H,12-13H2,1-10H3
- InChI Key
- LJLIAHFEXPDFCB-UHFFFAOYSA-N
- Formula
- C17H36N2O2Si3
- SMILES
-
Cc1ncc(CO[Si](C)(C)C)c(CN[Si](
C)(C)C)c1O[Si](C)(C)C - Molecular Weight1
- 384.74
- 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 | 0.7250 | Relay (1.0) Calculated Property | |
| ΔfG° | 55.82 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -657.10 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 73.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.880 | Crippen Calculated Property | |
| Pc | 521.13 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1948.00; 1972.00] |
|
|
| Inp | 1948.00 | NIST | |
| Inp | 1972.00 | NIST | |
| Inp | 1972.00 | NIST | |
| Inp | 1948.00 | NIST | |
| Tboil | 592.98 | K | Relay (1.0) Calculated Property |
| Tc | 804.42 | K | Relay (1.0) Calculated Property |
| Tfus | 327.87 | K | Relay (1.0) Calculated Property |
| Vc | 1.271 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Pyridoxamine, 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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