- InChI
- InChI=1S/C12H21N3/c1-4-5-6-7-8-13-12-11(3)14-9-10(2)15-12/h9H,4-8H2,1-3H3,(H,13,15)
- InChI Key
- PUUVJTVHJVLXCG-UHFFFAOYSA-N
- Formula
- C12H21N3
- SMILES
- CCCCCCNc1nc(C)cnc1C
- Molecular Weight1
- 207.32
- CAS
- 13134-55-9
- 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).
- 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 | 0.6488 | Relay (1.0) Calculated Property | |
| ΔfG° | 269.88 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -19.48 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 79.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.96 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.24 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.086 | Crippen Calculated Property | |
| McVol | 186.120 | ml/mol | McGowan Calculated Property |
| Pc | 2482.49 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 573.50 | K | Relay (1.0) Calculated Property |
| Tc | 786.95 | K | Relay (1.0) Calculated Property |
| Tfus | 328.72 | K | Relay (1.0) Calculated Property |
| Vc | 0.694 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-(N-n-hexylamino)-3,6-dimethyl pyrazine.
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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