- InChI
- InChI=1S/C16H30/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h14H,2-13,15H2,1H3
- InChI Key
- VBLCDRFXWQTOOY-UHFFFAOYSA-N
- Formula
- C16H30
- SMILES
- CCCCCCCCCCC1=CCCCC1
- Molecular Weight1
- 222.41
- CAS
- 62338-41-4
- 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).
- 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 | -237.90 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.47 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 6.018 | Crippen Calculated Property | |
| McVol | 221.140 | ml/mol | McGowan Calculated Property |
| Tboil | 561.37 | K | Relay (1.0) Calculated Property |
| Tfus | 251.75 | 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.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [300.59; 788.86] | 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 | -6.11210e+01 | |||
| Coefficient B | 1.55692e+00 | |||
| Coefficient C | -9.03240e-04 | |||
| Coefficient D | 1.96300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 300.59 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 385.33 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 460.99 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 528.20 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 587.59 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 639.78 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 685.37 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 725.00 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 759.29 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 788.86 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0046674; 0.0001933] | Pa×s | [294.98; 546.28] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.22895e+01 | |||
| Coefficient B | 2.04194e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 294.98 | |||
| Temperature range, max. | 546.28 | |||
| η | 0.0046674 | Pa×s | 294.98 | Calculated Property |
| η | 0.0025652 | Pa×s | 322.90 | Calculated Property |
| η | 0.0015507 | Pa×s | 350.82 | Calculated Property |
| η | 0.0010097 | Pa×s | 378.75 | Calculated Property |
| η | 0.0006973 | Pa×s | 406.67 | Calculated Property |
| η | 0.0005050 | Pa×s | 434.59 | Calculated Property |
| η | 0.0003803 | Pa×s | 462.51 | Calculated Property |
| η | 0.0002958 | Pa×s | 490.43 | Calculated Property |
| η | 0.0002364 | Pa×s | 518.35 | Calculated Property |
| η | 0.0001933 | Pa×s | 546.28 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexene, 1-decyl-.
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
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