- InChI
- InChI=1S/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h3-7,9,11H,1,8,10H2,2H3/b6-4+,7-5+,11-9+
- InChI Key
- GDBGMFOLEFOMEA-HZBLWPETSA-N
- Formula
- C11H16
- SMILES
- C=C/C=C/C=C\CC/C=C/C
- Molecular Weight1
- 148.25
- Other Names
-
- 1,(E)3,(Z)5,9-undecatetraene
- 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.
- I : 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 | 0.2751 | Relay (1.0) Calculated Property | |
| ΔfG° | 370.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 143.24 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.82 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.24 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.641 | Crippen Calculated Property | |
| McVol | 148.650 | ml/mol | McGowan Calculated Property |
| Pc | 2320.31 | kPa | Joback Calculated Property |
| Inp | [1174.00; 1174.00] |
|
|
| Inp | 1174.00 | NIST | |
| Inp | 1174.00 | NIST | |
| Inp | 1174.00 | NIST | |
| I | [1448.00; 1448.00] |
|
|
| I | 1448.00 | NIST | |
| I | 1448.00 | NIST | |
| Tboil | 452.99 | K | Relay (1.0) Calculated Property |
| Tc | 633.50 | K | Relay (1.0) Calculated Property |
| Tfus | 239.49 | K | Relay (1.0) Calculated Property |
| Vc | 0.509 | 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 | [295.88; 372.97] | J/mol×K | [460.24; 649.54] |
|
| Cp,gas | 295.88 | J/mol×K | 460.24 | Joback Calculated Property |
| Cp,gas | 310.73 | J/mol×K | 491.79 | Joback Calculated Property |
| Cp,gas | 324.71 | J/mol×K | 523.34 | Joback Calculated Property |
| Cp,gas | 337.87 | J/mol×K | 554.89 | Joback Calculated Property |
| Cp,gas | 350.26 | J/mol×K | 586.44 | Joback Calculated Property |
| Cp,gas | 361.95 | J/mol×K | 617.99 | Joback Calculated Property |
| Cp,gas | 372.97 | J/mol×K | 649.54 | Joback Calculated Property |
| η | [0.0001331; 0.0044996] | Pa×s | [196.73; 460.24] |
|
| η | 0.0044996 | Pa×s | 196.73 | Joback Calculated Property |
| η | 0.0014648 | Pa×s | 240.65 | Joback Calculated Property |
| η | 0.0006743 | Pa×s | 284.57 | Joback Calculated Property |
| η | 0.0003819 | Pa×s | 328.49 | Joback Calculated Property |
| η | 0.0002474 | Pa×s | 372.40 | Joback Calculated Property |
| η | 0.0001756 | Pa×s | 416.32 | Joback Calculated Property |
| η | 0.0001331 | Pa×s | 460.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3(E),5(Z),9-undecatetraene.
Sources
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