- InChI
- InChI=1S/C14H24N2/c1-5-6-7-8-9-10-14-13(4)15-11(2)12(3)16-14/h5-10H2,1-4H3
- InChI Key
- BFKCHPUASSLFPR-UHFFFAOYSA-N
- Formula
- C14H24N2
- SMILES
- CCCCCCCc1nc(C)c(C)nc1C
- Molecular Weight1
- 220.35
- CAS
- 116660-36-7
- 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 | 0.6492 | Relay (1.0) Calculated Property | |
| ΔfG° | 210.55 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -67.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 78.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.28 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.48 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.915 | Crippen Calculated Property | |
| McVol | 204.320 | ml/mol | McGowan Calculated Property |
| Pc | 1896.53 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 547.07 | K | Relay (1.0) Calculated Property |
| Tc | 764.55 | K | Relay (1.0) Calculated Property |
| Tfus | 290.48 | K | Relay (1.0) Calculated Property |
| Vc | 0.786 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-N-heptyl-3,5,6-trimethyl 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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