- InChI
- InChI=1S/C9H14N2/c1-6(2)9-8(4)10-5-7(3)11-9/h5-6H,1-4H3
- InChI Key
- NJTFLPVGROFSPU-UHFFFAOYSA-N
- Formula
- C9H14N2
- SMILES
- Cc1cnc(C)c(C(C)C)n1
- Molecular Weight1
- 150.22
- CAS
- 13610-20-3
- 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.
- 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 | 0.4282 | Relay (... Calculated Property | |
| ΔfG° | 189.93 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 22.19 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 57.44 | kJ/mol | Relay (... Calculated Property |
| IE | 8.70 | eV | Relay (... Calculated Property |
| log10WS | -0.84 | Relay (... Calculated Property | |
| logPoct/wat | 2.217 | Crippen Calculated Property | |
| McVol | 133.870 | ml/mol | McGowan Calculated Property |
| Pc | 2952.09 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1177.00 | NIST | |
| Tboil | 468.29 | K | Relay (... Calculated Property |
| Tc | 681.73 | K | Relay (... Calculated Property |
| Tfus | 281.49 | K | Relay (... Calculated Property |
| Vc | 0.498 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2,5-Dimethyl-3-isopropylpyrazine.
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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