- InChI
- InChI=1S/C14H26/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h5-6H,7-12H2,1-4H3/b6-5+
- InChI Key
- GNLGQSTXGUKFPN-AATRIKPKSA-N
- Formula
- C14H26
- SMILES
- CC1(C)CCC=CCCC(C)(C)CC1
- Molecular Weight1
- 194.36
- CAS
- 92369-75-0
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- 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).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.2760 | Relay (1.0) Calculated Property | |
| ΔfG° | 54.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -216.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 5.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.75 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.949 | Crippen Calculated Property | |
| McVol | 192.960 | ml/mol | McGowan Calculated Property |
| Pc | 2135.43 | kPa | Joback Calculated Property |
| Tboil | 522.04 | K | Relay (1.0) Calculated Property |
| Tc | 691.61 | K | Relay (1.0) Calculated Property |
| Tfus | 300.76 | K | Relay (1.0) Calculated Property |
| Vc | 0.664 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [232.72; 723.81] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.82190e+02 | |||
| Coefficient B | 1.91888e+00 | |||
| Coefficient C | -1.63028e-03 | |||
| Coefficient D | 6.17400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 232.72 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 319.96 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 394.47 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 458.22 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 513.14 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 561.20 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 604.34 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 644.52 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 683.69 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 723.81 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to 5,5,8,8-Tetramethylcyclodecene trans.
Sources
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