![Bicyclo[2.1.1]hex-2-ene](/cid/44-258-7/Bicyclo-2-1-1-hex-2-ene.png "Bicyclo[2.1.1]hex-2-ene")
- InChI
- InChI=1S/C6H8/c1-2-6-3-5(1)4-6/h1-2,5-6H,3-4H2
- InChI Key
- YWDBHFZUBPOPRQ-UHFFFAOYSA-N
- Formula
- C6H8
- SMILES
- C1=CC2CC1C2
- Molecular Weight1
- 80.13
- CAS
- 822-41-3
- 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).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical 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 | 251.00 | kJ/mol | NIST |
| ΔfusH° | 8.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 27.33 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.66 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.582 | Crippen Calculated Property | |
| McVol | 69.380 | ml/mol | McGowan Calculated Property |
| Pc | 4456.32 | kPa | Joback Calculated Property |
| Tboil | 341.47 | K | Relay (1.0) Calculated Property |
| Tc | 558.21 | K | Relay (1.0) Calculated Property |
| Tfus | 335.19 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate 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 | [113.21; 177.59] | J/mol×K | [349.52; 547.00] | 
|
| Cp,gas | 113.21 | J/mol×K | 349.52 | Joback Calculated Property |
| Cp,gas | 126.08 | J/mol×K | 382.43 | Joback Calculated Property |
| Cp,gas | 138.01 | J/mol×K | 415.35 | Joback Calculated Property |
| Cp,gas | 149.07 | J/mol×K | 448.26 | Joback Calculated Property |
| Cp,gas | 159.32 | J/mol×K | 481.17 | Joback Calculated Property |
| Cp,gas | 168.81 | J/mol×K | 514.09 | Joback Calculated Property |
| Cp,gas | 177.59 | J/mol×K | 547.00 | Joback Calculated Property |
| η | [0.0001813; 0.0003231] | Pa×s | [194.02; 349.52] |
|
| η | 0.0001813 | Pa×s | 194.02 | Joback Calculated Property |
| η | 0.0002113 | Pa×s | 219.94 | Joback Calculated Property |
| η | 0.0002384 | Pa×s | 245.85 | Joback Calculated Property |
| η | 0.0002629 | Pa×s | 271.77 | Joback Calculated Property |
| η | 0.0002850 | Pa×s | 297.69 | Joback Calculated Property |
| η | 0.0003050 | Pa×s | 323.60 | Joback Calculated Property |
| η | 0.0003231 | Pa×s | 349.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Bicyclo[2.1.1]hex-2-ene.
Sources
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