- InChI
- InChI=1S/C7H10N2/c1-3-7-5-8-4-6(2)9-7/h4-5H,3H2,1-2H3
- InChI Key
- RAFHQTNQEZECFL-UHFFFAOYSA-N
- Formula
- C7H10N2
- SMILES
- CCc1cncc(C)n1
- Molecular Weight1
- 122.17
- Other Names
-
- 2-Ethyl-6-methylpyrazine
- 2-Methyl-6-ethylpyrazine
- 2,6-Methylethylpyrazine
- Pyrazine, 6-ethyl-2-methyl
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Ip : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔvapH° | 54.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.08 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.347 | Crippen Calculated Property | |
| McVol | 105.690 | ml/mol | McGowan Calculated Property |
| Inp | [959.00; 1019.00] |
|
|
| Inp | 978.00 | NIST | |
| Inp | 991.00 | NIST | |
| Inp | 997.00 | NIST | |
| Inp | 1016.00 | NIST | |
| Inp | 1008.00 | NIST | |
| Inp | 1008.00 | NIST | |
| Inp | 1015.00 | NIST | |
| Inp | 1010.00 | NIST | |
| Inp | 976.00 | NIST | |
| Inp | 993.00 | NIST | |
| Inp | 1006.00 | NIST | |
| Inp | 1019.00 | NIST | |
| Inp | 997.00 | NIST | |
| Inp | 1002.00 | NIST | |
| Inp | 981.00 | NIST | |
| Inp | 1008.00 | NIST | |
| Inp | 1011.00 | NIST | |
| Inp | 1007.00 | NIST | |
| Inp | 969.00 | NIST | |
| Inp | 970.00 | NIST | |
| Inp | 970.00 | NIST | |
| Inp | 969.00 | NIST | |
| Inp | 961.00 | NIST | |
| Inp | 978.00 | NIST | |
| Inp | 980.00 | NIST | |
| Inp | 981.00 | NIST | |
| Inp | 981.00 | NIST | |
| Inp | 986.00 | NIST | |
| Inp | 1003.00 | NIST | |
| Inp | 1011.00 | NIST | |
| Inp | 1009.00 | NIST | |
| Inp | 1009.00 | NIST | |
| Inp | 1003.00 | NIST | |
| Inp | 1008.00 | NIST | |
| Inp | 1009.00 | NIST | |
| Inp | 1012.00 | NIST | |
| Inp | 994.00 | NIST | |
| Inp | 982.00 | NIST | |
| Inp | 982.00 | NIST | |
| Inp | 1001.00 | NIST | |
| Inp | 970.00 | NIST | |
| Inp | 998.00 | NIST | |
| Inp | 1014.00 | NIST | |
| Inp | 994.00 | NIST | |
| Inp | 1003.00 | NIST | |
| Inp | 1000.00 | NIST | |
| Inp | 995.00 | NIST | |
| Inp | 1006.00 | NIST | |
| Inp | 988.00 | NIST | |
| Inp | 997.00 | NIST | |
| Inp | 988.00 | NIST | |
| Inp | 967.00 | NIST | |
| Inp | 973.00 | NIST | |
| Inp | 977.00 | NIST | |
| Inp | 984.00 | NIST | |
| Inp | Outlier 959.00 | NIST | |
| Inp | 960.00 | NIST | |
| Inp | 969.00 | NIST | |
| Inp | 970.00 | NIST | |
| Inp | 971.00 | NIST | |
| Inp | 971.00 | NIST | |
| Inp | 977.00 | NIST | |
| Inp | 977.00 | NIST | |
| Inp | 986.00 | NIST | |
| Inp | 1001.00 | NIST | |
| Inp | 977.00 | NIST | |
| Inp | 969.00 | NIST | |
| Inp | 991.00 | NIST | |
| Inp | 1011.00 | NIST | |
| Inp | 1003.00 | NIST | |
| Inp | 1000.00 | NIST | |
| Inp | 991.00 | NIST | |
| Inp | 999.00 | NIST | |
| Inp | 992.00 | NIST | |
| Inp | 973.00 | NIST | |
| Inp | 973.00 | NIST | |
| Inp | 1010.00 | NIST | |
| Inp | 1010.00 | NIST | |
| Inp | 998.00 | NIST | |
| Inp | 986.00 | NIST | |
| Inp | 1003.00 | NIST | |
| Inp | 982.00 | NIST | |
| Ip | [1350.00; 1420.00] |
|
|
| Ip | 1363.00 | NIST | |
| Ip | 1393.00 | NIST | |
| Ip | 1381.00 | NIST | |
| Ip | 1385.00 | NIST | |
| Ip | 1395.00 | NIST | |
| Ip | 1395.00 | NIST | |
| Ip | 1371.00 | NIST | |
| Ip | 1375.00 | NIST | |
| Ip | 1386.00 | NIST | |
| Ip | 1390.00 | NIST | |
| Ip | 1390.00 | NIST | |
| Ip | 1381.00 | NIST | |
| Ip | 1371.00 | NIST | |
| Ip | 1386.00 | NIST | |
| Ip | 1386.00 | NIST | |
| Ip | 1387.00 | NIST | |
| Ip | 1402.00 | NIST | |
| Ip | 1413.00 | NIST | |
| Ip | 1380.00 | NIST | |
| Ip | 1382.00 | NIST | |
| Ip | 1380.00 | NIST | |
| Ip | 1386.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1362.00 | NIST | |
| Ip | 1398.00 | NIST | |
| Ip | 1408.00 | NIST | |
| Ip | 1372.00 | NIST | |
| Ip | Outlier 1420.00 | NIST | |
| Ip | 1375.00 | NIST | |
| Ip | 1398.00 | NIST | |
| Ip | 1375.00 | NIST | |
| Ip | 1357.00 | NIST | |
| Ip | 1396.00 | NIST | |
| Ip | 1415.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1392.00 | NIST | |
| Ip | 1383.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1380.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1380.00 | NIST | |
| Ip | 1394.00 | NIST | |
| Ip | 1380.00 | NIST | |
| Ip | 1399.00 | NIST | |
| Ip | 1382.00 | NIST | |
| Ip | 1367.00 | NIST | |
| Ip | Outlier 1350.00 | NIST | |
| Ip | 1364.00 | NIST | |
| Ip | 1353.00 | NIST | |
| Ip | 1381.00 | NIST | |
| Ip | 1367.00 | NIST | |
| Ip | 1353.00 | NIST | |
| Ip | 1390.00 | NIST | |
| Ip | 1372.00 | NIST | |
| Ip | 1388.00 | NIST | |
| Ip | 1392.00 | NIST | |
| Ip | 1364.00 | NIST | |
| Ip | 1381.00 | NIST | |
| Ip | 1391.00 | NIST | |
| Ip | 1411.00 | NIST | |
| Ip | 1389.00 | NIST | |
| Ip | 1388.00 | NIST | |
| Ip | 1353.00 | NIST | |
| Ip | 1353.00 | NIST | |
| Tboil | 444.58 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Similar Compounds
Find more compounds similar to Pyrazine, 2-ethyl-6-methyl-.
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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that the value is more than 2 standard deviations away from the
property mean.
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