- InChI
- InChI=1S/C8H14/c1-8-6-4-2-3-5-7-8/h1-7H2
- InChI Key
- XJYOAWSHIQNEGC-UHFFFAOYSA-N
- Formula
- C8H14
- SMILES
- C=C1CCCCCC1
- Molecular Weight1
- 110.20
- 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.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -34.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 3.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.05 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.897 | Crippen Calculated Property | |
| McVol | 108.420 | ml/mol | McGowan Calculated Property |
| Inp | 861.00 | NIST | |
| Tboil | 403.03 | K | Relay (1.0) Calculated Property |
| Tfus | 194.77 | 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 | [198.93; 286.69] | J/mol×K | [410.29; 622.33] | 
|
| Cp,gas | 198.93 | J/mol×K | 410.29 | Joback Calculated Property |
| Cp,gas | 215.53 | J/mol×K | 445.63 | Joback Calculated Property |
| Cp,gas | 231.32 | J/mol×K | 480.97 | Joback Calculated Property |
| Cp,gas | 246.31 | J/mol×K | 516.31 | Joback Calculated Property |
| Cp,gas | 260.53 | J/mol×K | 551.65 | Joback Calculated Property |
| Cp,gas | 273.98 | J/mol×K | 586.99 | Joback Calculated Property |
| Cp,gas | 286.69 | J/mol×K | 622.33 | Joback Calculated Property |
| η | [0.0002569; 0.0111689] | Pa×s | [201.70; 410.29] |
|
| η | 0.0111689 | Pa×s | 201.70 | Joback Calculated Property |
| η | 0.0037518 | Pa×s | 236.46 | Joback Calculated Property |
| η | 0.0016669 | Pa×s | 271.23 | Joback Calculated Property |
| η | 0.0008905 | Pa×s | 306.00 | Joback Calculated Property |
| η | 0.0005407 | Pa×s | 340.76 | Joback Calculated Property |
| η | 0.0003600 | Pa×s | 375.52 | Joback Calculated Property |
| η | 0.0002569 | Pa×s | 410.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cycloheptane, methylene.
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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