- InChI
- InChI=1S/C9H14N2/c1-4-5-9-8(3)11-7(2)6-10-9/h6H,4-5H2,1-3H3
- InChI Key
- UTRAUCDSVCDVIW-UHFFFAOYSA-N
- Formula
- C9H14N2
- SMILES
- CCCc1ncc(C)nc1C
- Molecular Weight1
- 150.22
- CAS
- 32350-16-6
- Other Names
-
- 2,6-Dimethyl-3-propylpyrazine
- Pyrazine, 2,6-dimethyl-3-propyl-
- 3,5-Dimethyl-2-propylpyrazine
- 2,6-Dimethyl-3-pyropylpyrazine
- 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 | 0.4666 | Relay (... Calculated Property | |
| ΔfG° | 191.09 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 42.57 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 57.34 | kJ/mol | Relay (... Calculated Property |
| IE | 8.56 | eV | Relay (... Calculated Property |
| log10WS | -0.78 | Relay (... Calculated Property | |
| logPoct/wat | 2.046 | Crippen Calculated Property | |
| McVol | 133.870 | ml/mol | McGowan Calculated Property |
| Pc | 2963.49 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1130.00; 1152.00] |
|
|
| Inp | 1131.00 | NIST | |
| Inp | 1131.00 | NIST | |
| Inp | 1130.00 | NIST | |
| Inp | 1151.00 | NIST | |
| Inp | 1152.00 | NIST | |
| Inp | 1151.00 | NIST | |
| I | 1493.00 | NIST | |
| Tboil | 476.54 | K | Relay (... Calculated Property |
| Tc | 692.92 | K | Relay (... Calculated Property |
| Tfus | 257.02 | K | Relay (... Calculated Property |
| Vc | 0.505 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Pyrazine, 3,5-dimethyl-2-propyl-.
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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