- InChI
- InChI=1S/C12H18/c1-3-5-7-9-11-12-10-8-6-4-2/h3-7,9,11-12H,8,10H2,1-2H3/b5-3?,6-4+,9-7+,12-11+
- InChI Key
- FQMSKVLEYYJMON-YXDPKGGVSA-N
- Formula
- C12H18
- SMILES
- C/C=C/C=C/C=C/CC/C=C/C
- Molecular Weight1
- 162.28
- 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).
- 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 | 0.2865 | Relay (1.0) Calculated Property | |
| ΔfG° | 371.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 108.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.06 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.92 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.031 | Crippen Calculated Property | |
| McVol | 162.740 | ml/mol | McGowan Calculated Property |
| Pc | 2139.38 | kPa | Joback Calculated Property |
| Inp | [1321.00; 1324.00] |
|
|
| Inp | 1321.00 | NIST | |
| Inp | 1324.00 | NIST | |
| Tboil | 478.16 | K | Relay (1.0) Calculated Property |
| Tc | 663.18 | K | Relay (1.0) Calculated Property |
| Tfus | 294.90 | K | Relay (1.0) Calculated Property |
| Vc | 0.564 | 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 | [341.63; 423.67] | J/mol×K | [490.80; 682.95] |
|
| Cp,gas | 341.63 | J/mol×K | 490.80 | Joback Calculated Property |
| Cp,gas | 357.45 | J/mol×K | 522.82 | Joback Calculated Property |
| Cp,gas | 372.33 | J/mol×K | 554.85 | Joback Calculated Property |
| Cp,gas | 386.33 | J/mol×K | 586.87 | Joback Calculated Property |
| Cp,gas | 399.51 | J/mol×K | 618.90 | Joback Calculated Property |
| Cp,gas | 411.93 | J/mol×K | 650.92 | Joback Calculated Property |
| Cp,gas | 423.67 | J/mol×K | 682.95 | Joback Calculated Property |
| η | [0.0001069; 0.0049325] | Pa×s | [204.68; 490.80] |
|
| η | 0.0049325 | Pa×s | 204.68 | Joback Calculated Property |
| η | 0.0014246 | Pa×s | 252.37 | Joback Calculated Property |
| η | 0.0006106 | Pa×s | 300.05 | Joback Calculated Property |
| η | 0.0003302 | Pa×s | 347.74 | Joback Calculated Property |
| η | 0.0002071 | Pa×s | 395.43 | Joback Calculated Property |
| η | 0.0001436 | Pa×s | 443.11 | Joback Calculated Property |
| η | 0.0001069 | Pa×s | 490.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4,6,10-Dodecatetraene.
Sources
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