- InChI
- InChI=1S/C13H24N2/c1-4-5-6-7-8-9-13-12(3)14-10-11(2)15-13/h11H,4-10H2,1-3H3
- InChI Key
- VLFBCIPUHLLJEH-UHFFFAOYSA-N
- Formula
- C13H24N2
- SMILES
- CCCCCCCC1=NC(C)CN=C1C
- Molecular Weight1
- 208.34
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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 |
|---|---|---|---|
| ΔfG° | 357.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -22.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.29 | kJ/mol | Joback Calculated Property |
| log10WS | -3.60 | Crippen Calculated Property | |
| logPoct/wat | 3.651 | Crippen Calculated Property | |
| McVol | 194.530 | ml/mol | McGowan Calculated Property |
| Pc | 2034.55 | kPa | Joback Calculated Property |
| Inp | [1498.00; 1498.00] |
|
|
| Inp | 1498.00 | NIST | |
| Inp | 1498.00 | NIST | |
| Tboil | 632.07 | K | Joback Calculated Property |
| Tc | 843.07 | K | Joback Calculated Property |
| Tfus | 413.29 | K | Joback Calculated Property |
| Vc | 0.766 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [555.86; 663.41] | J/mol×K | [632.07; 843.07] |
|
| Cp,gas | 555.86 | J/mol×K | 632.07 | Joback Calculated Property |
| Cp,gas | 576.73 | J/mol×K | 667.24 | Joback Calculated Property |
| Cp,gas | 596.43 | J/mol×K | 702.40 | Joback Calculated Property |
| Cp,gas | 614.95 | J/mol×K | 737.57 | Joback Calculated Property |
| Cp,gas | 632.28 | J/mol×K | 772.74 | Joback Calculated Property |
| Cp,gas | 648.44 | J/mol×K | 807.90 | Joback Calculated Property |
| Cp,gas | 663.41 | J/mol×K | 843.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-heptyl-2,5-dimethyl-5,6-dihydropyrazine.
Sources
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