- InChI
- InChI=1S/C12H24/c1-11(2,3)9-7-8-10-12(4,5)6/h7-8H,9-10H2,1-6H3/b8-7+
- InChI Key
- VUVGYCAGSXOGCC-BQYQJAHWSA-N
- Formula
- C12H24
- SMILES
- CC(C)(C)CC=CCC(C)(C)C
- Molecular Weight1
- 168.32
- CAS
- 5223-58-5
- 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).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 12.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.78 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.415 | Crippen Calculated Property | |
| McVol | 175.640 | ml/mol | McGowan Calculated Property |
| Tboil | 454.34 | K | Relay (1.0) Calculated Property |
| Tc | 621.65 | K | Relay (1.0) Calculated Property |
| Tfus | 267.93 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate 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 | [395.36; 496.06] | J/mol×K | [471.66; 660.75] | 
|
| Cp,gas | 395.36 | J/mol×K | 471.66 | Joback Calculated Property |
| Cp,gas | 414.76 | J/mol×K | 503.17 | Joback Calculated Property |
| Cp,gas | 433.04 | J/mol×K | 534.69 | Joback Calculated Property |
| Cp,gas | 450.25 | J/mol×K | 566.20 | Joback Calculated Property |
| Cp,gas | 466.45 | J/mol×K | 597.72 | Joback Calculated Property |
| Cp,gas | 481.70 | J/mol×K | 629.23 | Joback Calculated Property |
| Cp,gas | 496.06 | J/mol×K | 660.75 | Joback Calculated Property |
| η | [0.0001778; 0.0147728] | Pa×s | [224.76; 471.66] |
|
| η | 0.0147728 | Pa×s | 224.76 | Joback Calculated Property |
| η | 0.0039996 | Pa×s | 265.91 | Joback Calculated Property |
| η | 0.0015370 | Pa×s | 307.06 | Joback Calculated Property |
| η | 0.0007404 | Pa×s | 348.21 | Joback Calculated Property |
| η | 0.0004162 | Pa×s | 389.36 | Joback Calculated Property |
| η | 0.0002612 | Pa×s | 430.51 | Joback Calculated Property |
| η | 0.0001778 | Pa×s | 471.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2,2,7,7-Tetramethyl-4-octene.
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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