- InChI
- InChI=1S/C23H35N3/c1-5-6-7-8-9-10-11-16-23(3,4)20-12-14-21(15-13-20)26-22-19(2)24-17-18-25-22/h12-15,17-18H,5-11,16H2,1-4H3,(H,25,26)
- InChI Key
- GKBAEGMOHNLNKJ-UHFFFAOYSA-N
- Formula
- C23H35N3
- SMILES
-
CCCCCCCCCC(C)(C)c1ccc(Nc2nccnc
2C)cc1 - Molecular Weight1
- 353.54
- CAS
- 116402-82-5
- 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.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- 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 | 0.9048 | Relay (1.0) Calculated Property | |
| ΔfG° | 417.93 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -33.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 119.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.947 | Crippen Calculated Property | |
| McVol | 317.350 | ml/mol | McGowan Calculated Property |
| Pc | 1839.91 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 678.48 | K | Relay (1.0) Calculated Property |
| Tc | 963.87 | K | Relay (1.0) Calculated Property |
| Tfus | 369.52 | K | Relay (1.0) Calculated Property |
| Vc | 1.156 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-(P-t-dodecylanilino)-3-methyl pyrazine.
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
- McGowan Method
- NIST Webbook
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