- InChI
- InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h6,8H,3-5,7H2,1-2H3
- InChI Key
- SCWPFSIZUZUCCE-UHFFFAOYSA-N
- Formula
- C10H16
- SMILES
- C=C1CC=C(C(C)C)CC1
- Molecular Weight1
- 136.23
- CAS
- 99-84-3
- Other Names
-
- p-Mentha-1(7),3-diene
- «beta»-Terpinen
- «beta»-Terpinene
- Beta terpinene
- Cyclohexene, 4-methylene-1-isopropyl
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 70.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 8.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.75 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 3.309 | Crippen Calculated Property | |
| McVol | 132.300 | ml/mol | McGowan Calculated Property |
| Inp | [988.00; 1056.00] |
|
|
| Inp | 1036.00 | NIST | |
| Inp | 1051.00 | NIST | |
| Inp | 1019.00 | NIST | |
| Inp | 1049.00 | NIST | |
| Inp | Outlier 988.00 | NIST | |
| Inp | 1056.00 | NIST | |
| Inp | 1020.00 | NIST | |
| Inp | 1051.00 | NIST | |
| I | [1177.00; 1254.00] |
|
|
| I | 1232.00 | NIST | |
| I | 1206.00 | NIST | |
| I | 1254.00 | NIST | |
| I | 1218.00 | NIST | |
| I | 1206.00 | NIST | |
| I | 1177.00 | NIST | |
| Tboil | 437.91 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 | [169.50; 447.94] | 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 | -3.50600e+01 | |||
| Coefficient B | 8.75340e-01 | |||
| Coefficient C | -4.87640e-04 | |||
| Coefficient D | 9.53000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 169.50 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 217.80 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 261.06 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 299.57 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 333.64 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 363.58 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 389.67 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 412.23 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 431.55 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 447.94 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0048809; 0.0002221] | Pa×s | [226.04; 463.86] |
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 | -1.13496e+01 | |||
| Coefficient B | 1.36238e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 226.04 | |||
| Temperature range, max. | 463.86 | |||
| η | 0.0048809 | Pa×s | 226.04 | Calculated Property |
| η | 0.0025973 | Pa×s | 252.46 | Calculated Property |
| η | 0.0015576 | Pa×s | 278.89 | Calculated Property |
| η | 0.0010206 | Pa×s | 305.31 | Calculated Property |
| η | 0.0007153 | Pa×s | 331.74 | Calculated Property |
| η | 0.0005283 | Pa×s | 358.16 | Calculated Property |
| η | 0.0004068 | Pa×s | 384.59 | Calculated Property |
| η | 0.0003240 | Pa×s | 411.01 | Calculated Property |
| η | 0.0002652 | Pa×s | 437.44 | Calculated Property |
| η | 0.0002221 | Pa×s | 463.86 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexene, 4-methylene-1-(1-methylethyl)-.
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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