- InChI
- InChI=1S/C22H32N2O/c1-2-3-4-5-6-7-8-9-10-11-12-20-13-15-21(16-14-20)25-22-19-23-17-18-24-22/h13-19H,2-12H2,1H3
- InChI Key
- MLOJPIGVCAHKEM-UHFFFAOYSA-N
- Formula
- C22H32N2O
- SMILES
-
CCCCCCCCCCCCc1ccc(Oc2cnccn2)cc
1 - Molecular Weight1
- 340.50
- CAS
- 116660-31-2
- 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 | 0.9727 | Relay (... Calculated Property | |
| ΔfG° | 278.11 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -133.83 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 114.34 | kJ/mol | Relay (... Calculated Property |
| IE | 8.74 | eV | Relay (... Calculated Property |
| log10WS | -7.09 | Relay (... Calculated Property | |
| logPoct/wat | 6.732 | Crippen Calculated Property | |
| McVol | 299.150 | ml/mol | McGowan Calculated Property |
| Pc | 1582.70 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 669.90 | K | Relay (... Calculated Property |
| Tc | 907.89 | K | Relay (... Calculated Property |
| Tfus | 316.52 | K | Relay (... Calculated Property |
| Vc | 1.136 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2-(P-dodecylphenoxy) 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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