- InChI
- InChI=1S/C16H20N2O/c1-11-10-17-12(2)15(18-11)19-14-8-6-13(7-9-14)16(3,4)5/h6-10H,1-5H3
- InChI Key
- SZJTXDUFOSJTMM-UHFFFAOYSA-N
- Formula
- C16H20N2O
- SMILES
-
Cc1cnc(C)c(Oc2ccc(C(C)(C)C)cc2
)n1 - Molecular Weight1
- 256.34
- CAS
- 116660-13-0
- 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 | 0.5980 | Relay (... Calculated Property | |
| ΔfG° | 207.53 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -46.27 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 79.77 | kJ/mol | Relay (... Calculated Property |
| IE | 7.95 | eV | Relay (... Calculated Property |
| log10WS | -4.56 | Relay (... Calculated Property | |
| logPoct/wat | 4.183 | Crippen Calculated Property | |
| McVol | 214.610 | ml/mol | McGowan Calculated Property |
| Pc | 2228.85 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 590.01 | K | Relay (... Calculated Property |
| Tc | 860.87 | K | Relay (... Calculated Property |
| Tfus | 343.30 | K | Relay (... Calculated Property |
| Vc | 0.794 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 3-(P-t-butylphenoxy)-2,5-dimethyl 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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