- InChI
- InChI=1S/C9H14/c1-3-5-7-9-8-6-4-2/h3,5-9H,4H2,1-2H3/b5-3+,8-6+,9-7+
- InChI Key
- QTRAFXCHKGPQFY-JKNUXMOISA-N
- Formula
- C9H14
- SMILES
- C\C=C/C=C/C=C/CC
- Molecular Weight1
- 122.21
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- IE : Ionization energy (eV).
- 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 | 0.2250 | Relay (1.0) Calculated Property | |
| ΔfG° | 265.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 70.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.76 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.85 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.085 | Crippen Calculated Property | |
| McVol | 124.770 | ml/mol | McGowan Calculated Property |
| Pc | 2695.80 | kPa | Joback Calculated Property |
| Tboil | 418.93 | K | Relay (1.0) Calculated Property |
| Tc | 610.93 | K | Relay (1.0) Calculated Property |
| Tfus | 260.51 | K | Relay (1.0) Calculated Property |
| Vc | 0.446 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [228.22; 298.80] | J/mol×K | [417.80; 606.70] | 
|
| Cp,gas | 228.22 | J/mol×K | 417.80 | Joback Calculated Property |
| Cp,gas | 241.80 | J/mol×K | 449.28 | Joback Calculated Property |
| Cp,gas | 254.60 | J/mol×K | 480.77 | Joback Calculated Property |
| Cp,gas | 266.65 | J/mol×K | 512.25 | Joback Calculated Property |
| Cp,gas | 278.00 | J/mol×K | 543.73 | Joback Calculated Property |
| Cp,gas | 288.71 | J/mol×K | 575.22 | Joback Calculated Property |
| Cp,gas | 298.80 | J/mol×K | 606.70 | Joback Calculated Property |
| η | [0.0001385; 0.0049437] | Pa×s | [175.95; 417.80] |
|
| η | 0.0049437 | Pa×s | 175.95 | Joback Calculated Property |
| η | 0.0015637 | Pa×s | 216.26 | Joback Calculated Property |
| η | 0.0007101 | Pa×s | 256.57 | Joback Calculated Property |
| η | 0.0003996 | Pa×s | 296.88 | Joback Calculated Property |
| η | 0.0002580 | Pa×s | 337.18 | Joback Calculated Property |
| η | 0.0001829 | Pa×s | 377.49 | Joback Calculated Property |
| η | 0.0001385 | Pa×s | 417.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z,E,E)-2,4,6-nonatriene.
Sources
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