- InChI
- InChI=1S/C9H14/c1-3-8-6-5-7-9(8)4-2/h3-4H,5-7H2,1-2H3/b8-3-,9-4+
- InChI Key
- PSMXGHHIXPUKSP-SNXNNQDSSA-N
- Formula
- C9H14
- SMILES
- CC=C1CCCC1=CC
- Molecular Weight1
- 122.21
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 6.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.12 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.063 | Crippen Calculated Property | |
| McVol | 118.210 | ml/mol | McGowan Calculated Property |
| Inp | [969.00; 969.00] |
|
|
| Inp | 969.00 | NIST | |
| Inp | 969.00 | NIST | |
| Tboil | 434.48 | K | Relay (1.0) Calculated Property |
| Tfus | 234.72 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [229.94; 307.33] | J/mol×K | [438.75; 645.24] |
|
| Cp,gas | 229.94 | J/mol×K | 438.75 | Joback Calculated Property |
| Cp,gas | 244.78 | J/mol×K | 473.16 | Joback Calculated Property |
| Cp,gas | 258.79 | J/mol×K | 507.58 | Joback Calculated Property |
| Cp,gas | 272.01 | J/mol×K | 541.99 | Joback Calculated Property |
| Cp,gas | 284.48 | J/mol×K | 576.41 | Joback Calculated Property |
| Cp,gas | 296.24 | J/mol×K | 610.82 | Joback Calculated Property |
| Cp,gas | 307.33 | J/mol×K | 645.24 | Joback Calculated Property |
| η | [0.0002263; 0.0023157] | Pa×s | [227.05; 438.75] |
|
| η | 0.0023157 | Pa×s | 227.05 | Joback Calculated Property |
| η | 0.0012110 | Pa×s | 262.33 | Joback Calculated Property |
| η | 0.0007385 | Pa×s | 297.62 | Joback Calculated Property |
| η | 0.0005001 | Pa×s | 332.90 | Joback Calculated Property |
| η | 0.0003650 | Pa×s | 368.18 | Joback Calculated Property |
| η | 0.0002814 | Pa×s | 403.47 | Joback Calculated Property |
| η | 0.0002263 | Pa×s | 438.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E,Z)-1,2-Diethylidenecyclopentane.
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
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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