- InChI
- InChI=1S/C8H14/c1-2-8-6-4-3-5-7-8/h2,8H,1,3-7H2
- InChI Key
- LDLDYFCCDKENPD-UHFFFAOYSA-N
- Formula
- C8H14
- SMILES
- C=CC1CCCCC1
- Molecular Weight1
- 110.20
- CAS
- 695-12-5
- Other Names
-
- Cyclohexane, vinyl-
- Cyclohexylethylene
- Ethenylcyclohexane
- Vinylcyclohexane
- Cyclohexylethene
- 1-Vinylcyclohexane
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase 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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ΔcH°liquid | -5060.21 ± 0.75 | kJ/mol | NIST |
| ΔfH°gas | -23.48 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°liquid | -88.78 ± 0.88 | kJ/mol | NIST |
| ΔfusH° | 7.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [39.70; 39.70] | kJ/mol |
|
| ΔvapH° | 39.70 ± 0.30 | kJ/mol | NIST |
| ΔvapH° | 39.70 ± 0.20 | kJ/mol | NIST |
| IE | 9.51 | eV | NIST |
| logPoct/wat | 2.753 | Crippen Calculated Property | |
| McVol | 108.420 | ml/mol | McGowan Calculated Property |
| Inp | [813.00; 839.00] |
|
|
| Inp | 829.00 | NIST | |
| Inp | 823.00 | NIST | |
| Inp | 826.70 | NIST | |
| Inp | 821.40 | NIST | |
| Inp | 838.50 | NIST | |
| Inp | 831.90 | NIST | |
| Inp | 830.00 | NIST | |
| Inp | 823.00 | NIST | |
| Inp | 829.00 | NIST | |
| Inp | 823.00 | NIST | |
| Inp | 830.00 | NIST | |
| Inp | 829.80 | NIST | |
| Inp | 839.00 | NIST | |
| Inp | 824.00 | NIST | |
| Inp | 818.00 | NIST | |
| Inp | 813.00 | NIST | |
| Inp | 818.00 | NIST | |
| Inp | 824.00 | NIST | |
| Inp | 813.00 | NIST | |
| Inp | 818.00 | NIST | |
| Tboil | [400.20; 401.20] | K |
|
| Tboil | 401.20 | K | NIST |
| Tboil | 400.20 ± 1.00 | K | NIST |
| Tfus | [146.37; 146.53] | K |
|
| Tfus | 146.37 ± 0.03 | K | NIST |
| Tfus | 146.37 ± 0.02 | K | NIST |
| Tfus | 146.39 ± 0.01 | K | NIST |
| Tfus | 146.38 ± 0.02 | K | NIST |
| Tfus | 146.39 ± 0.01 | K | NIST |
| Tfus | 146.47 ± 0.10 | K | NIST |
| Tfus | 146.47 ± 0.15 | K | NIST |
| Tfus | 146.47 ± 0.10 | K | NIST |
| Tfus | 146.37 ± 0.06 | K | NIST |
| Tfus | 146.39 ± 0.01 | K | NIST |
| Tfus | 146.38 ± 0.05 | K | NIST |
| Tfus | 146.39 ± 0.01 | K | NIST |
| Tfus | Outlier 146.53 ± 0.05 | K | NIST |
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 | [127.26; 388.62] | 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 | -7.29800e+01 | |||
| Coefficient B | 8.65900e-01 | |||
| Coefficient C | -5.15300e-04 | |||
| Coefficient D | 1.11000e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 127.26 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 173.78 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 215.10 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 251.59 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 283.59 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 311.46 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 335.55 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 356.20 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 373.78 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 388.62 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0350747; 0.0002327] | Pa×s | [146.40; 423.10] |
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 | -1.10197e+01 | |||
| Coefficient B | 1.12283e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 146.40 | |||
| Temperature range, max. | 423.10 | |||
| η | 0.0350747 | Pa×s | 146.40 | Calculated Property |
| η | 0.0092668 | Pa×s | 177.15 | Calculated Property |
| η | 0.0036295 | Pa×s | 207.89 | Calculated Property |
| η | 0.0018099 | Pa×s | 238.64 | Calculated Property |
| η | 0.0010579 | Pa×s | 269.38 | Calculated Property |
| η | 0.0006902 | Pa×s | 300.12 | Calculated Property |
| η | 0.0004875 | Pa×s | 330.87 | Calculated Property |
| η | 0.0003654 | Pa×s | 361.61 | Calculated Property |
| η | 0.0002865 | Pa×s | 392.36 | Calculated Property |
| η | 0.0002327 | Pa×s | 423.10 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexane, ethenyl-.
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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