- InChI
- InChI=1S/C15H30N4O3Si2/c1-23(2,3)18-8-7-14(20)19-13(9-12-10-16-11-17-12)15(21)22-24(4,5)6/h10-11,13,18H,7-9H2,1-6H3,(H,16,17)(H,19,20)
- InChI Key
- NXLUQYPGVPBDSQ-UHFFFAOYSA-N
- Formula
- C15H30N4O3Si2
- SMILES
-
C[Si](C)(C)NCCC(=O)NC(Cc1cnc[n
H]1)C(=O)O[Si](C)(C)C - Molecular Weight1
- 370.59
- 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 | 0.8143 | Relay (1.0) Calculated Property | |
| ΔfG° | 1.65 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -746.98 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 108.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.88 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.52 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.148 | Crippen Calculated Property | |
| Pc | 996.27 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2543.00 | NIST | |
| Tboil | 632.74 | K | Relay (1.0) Calculated Property |
| Tc | 877.34 | K | Relay (1.0) Calculated Property |
| Tfus | 380.70 | K | Relay (1.0) Calculated Property |
| Vc | 1.108 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Carnosine, 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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