- InChI
- InChI=1S/C8H12N2/c1-3-7-5-10-8(4-2)6-9-7/h5-6H,3-4H2,1-2H3
- InChI Key
- WAVOLMBVDCRBGR-UHFFFAOYSA-N
- Formula
- C8H12N2
- SMILES
- CCc1cnc(CC)cn1
- Molecular Weight1
- 136.19
- CAS
- 13238-84-1
- Other Names
-
- 2,5-Diethylpyrazine
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.4517 | Relay (1.0) Calculated Property | |
| ΔfG° | 192.52 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 70.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 54.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.96 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.601 | Crippen Calculated Property | |
| McVol | 119.780 | ml/mol | McGowan Calculated Property |
| Pc | 3315.97 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1048.00; 1095.00] |
|
|
| Inp | 1091.00 | NIST | |
| Inp | 1089.00 | NIST | |
| Inp | 1074.00 | NIST | |
| Inp | 1064.00 | NIST | |
| Inp | 1090.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1095.00 | NIST | |
| Inp | 1087.00 | NIST | |
| Inp | 1062.00 | NIST | |
| Inp | 1063.00 | NIST | |
| Inp | Outlier 1048.00 | NIST | |
| Inp | 1085.00 | NIST | |
| Inp | 1091.00 | NIST | |
| Inp | 1091.00 | NIST | |
| Inp | 1077.00 | NIST | |
| Inp | 1091.00 | NIST | |
| I | [1425.00; 1492.00] |
|
|
| I | 1461.00 | NIST | |
| I | 1460.00 | NIST | |
| I | 1463.00 | NIST | |
| I | 1425.00 | NIST | |
| I | 1445.00 | NIST | |
| I | 1443.00 | NIST | |
| I | Outlier 1492.00 | NIST | |
| I | 1449.00 | NIST | |
| I | 1456.00 | NIST | |
| I | 1433.00 | NIST | |
| I | 1463.00 | NIST | |
| Tboil | 463.70 | K | Relay (1.0) Calculated Property |
| Tc | 680.55 | K | Relay (1.0) Calculated Property |
| Tfus | 258.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.462 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Pyrazine, 2,5-diethyl-.
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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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.