- InChI
- InChI=1S/C8H10N2/c1-3-4-8-7(2)9-5-6-10-8/h3-6H,1-2H3/b4-3+
- InChI Key
- ZCGRXTTWRNXLQZ-ONEGZZNKSA-N
- Formula
- C8H10N2
- SMILES
- CC=Cc1nccnc1C
- Molecular Weight1
- 134.18
- CAS
- 115610-67-8
- 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).
- I : 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 | 0.3617 | Relay (1.0) Calculated Property | |
| ΔfG° | 250.35 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 189.78 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 60.14 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.818 | Crippen Calculated Property | |
| McVol | 115.480 | ml/mol | McGowan Calculated Property |
| Pc | 4216.90 | kPa | Relay (1.0-beta) Calculated Property |
| I | 1636.00 | NIST | |
| Tboil | 472.01 | K | Relay (1.0) Calculated Property |
| Tc | 698.82 | K | Relay (1.0) Calculated Property |
| Tfus | 280.78 | K | Relay (1.0) Calculated Property |
| Vc | 0.415 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-3-trans-propenylpyrazine.
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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