- InChI
- InChI=1S/C10H18/c1-10(2,3)9-7-5-4-6-8-9/h4-5,9H,6-8H2,1-3H3
- InChI Key
- PJTMQLHFQYFBBB-UHFFFAOYSA-N
- Formula
- C10H18
- SMILES
- CC(C)(C)C1CC=CCC1
- Molecular Weight1
- 138.25
- Other Names
-
- Cyclohexene, 4-tert-butyl-
- 4-tert-Butyl-1-cyclohexene
- 4-tert-Butylcyclohexene
- 4-tertiary-Butylcyclohexene
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 |
|---|---|---|---|
| ΔfusH° | 7.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.92 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.389 | Crippen Calculated Property | |
| McVol | 136.600 | ml/mol | McGowan Calculated Property |
| Tboil | 436.00 ± 4.00 | K | NIST |
| Tfus | 225.21 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, 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 | [287.09; 390.60] | J/mol×K | [443.68; 656.08] | 
|
| Cp,gas | 287.09 | J/mol×K | 443.68 | Joback Calculated Property |
| Cp,gas | 307.19 | J/mol×K | 479.08 | Joback Calculated Property |
| Cp,gas | 326.08 | J/mol×K | 514.48 | Joback Calculated Property |
| Cp,gas | 343.82 | J/mol×K | 549.88 | Joback Calculated Property |
| Cp,gas | 360.45 | J/mol×K | 585.28 | Joback Calculated Property |
| Cp,gas | 376.03 | J/mol×K | 620.68 | Joback Calculated Property |
| Cp,gas | 390.60 | J/mol×K | 656.08 | Joback Calculated Property |
| η | [0.0002635; 0.0107881] | Pa×s | [213.02; 443.68] |
|
| η | 0.0107881 | Pa×s | 213.02 | Joback Calculated Property |
| η | 0.0036212 | Pa×s | 251.46 | Joback Calculated Property |
| η | 0.0016236 | Pa×s | 289.91 | Joback Calculated Property |
| η | 0.0008784 | Pa×s | 328.35 | Joback Calculated Property |
| η | 0.0005406 | Pa×s | 366.79 | Joback Calculated Property |
| η | 0.0003647 | Pa×s | 405.24 | Joback Calculated Property |
| η | 0.0002635 | Pa×s | 443.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexene, 4-(1,1-dimethylethyl)-.
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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