- InChI
- InChI=1S/C25H31ClN2O2Si2/c1-31(2,3)28(25(29)20-14-16-27-17-15-20)23-13-12-21(26)18-22(23)24(30-32(4,5)6)19-10-8-7-9-11-19/h7-18,24H,1-6H3
- InChI Key
- ISBVUOUPPNNVAA-UHFFFAOYSA-N
- Formula
- C25H31ClN2O2Si2
- SMILES
-
C[Si](C)(C)OC(c1ccccc1)c1cc(Cl
)ccc1N(C(=O)c1ccncc1)[Si](C)(C )C - Molecular Weight1
- 483.15
- 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 | 0.8236 | Relay (1.0) Calculated Property | |
| ΔfG° | 285.84 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -317.91 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 117.61 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.66 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.92 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.158 | Crippen Calculated Property | |
| Pc | 535.70 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2710.20 | NIST | |
| Tboil | 708.49 | K | Relay (1.0) Calculated Property |
| Tc | 1037.49 | K | Relay (1.0) Calculated Property |
| Tfus | 376.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.385 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Inabenfide, N,O-bis(trimethylsilyl)-.
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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