- InChI
- InChI=1S/C8H14/c1-8(2)6-4-3-5-7-8/h3-4H,5-7H2,1-2H3
- InChI Key
- DRORSPJLYCDESA-UHFFFAOYSA-N
- Formula
- C8H14
- SMILES
- CC1(C)CC=CCC1
- Molecular Weight1
- 110.20
- CAS
- 14072-86-7
- Other Names
-
- 1-Cyclohexene, 4,4-dimethyl-
- 4,4-DIMETHYL-1-CYCLOHEXENE
- 4,4-Dimethylcyclohexene
- 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).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor 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 |
|---|---|---|---|
| ΔfG° | 65.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -81.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 3.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 32.97 | kJ/mol | Joback Calculated Property |
| log10WS | -2.68 | Crippen Calculated Property | |
| logPoct/wat | 2.753 | Crippen Calculated Property | |
| McVol | 108.420 | ml/mol | McGowan Calculated Property |
| Pc | 3460.21 | kPa | Joback Calculated Property |
| Tboil | 394.00 ± 5.00 | K | NIST |
| Tc | 613.90 | K | Joback Calculated Property |
| Tfus | 211.96 | K | Joback Calculated Property |
| Vc | 0.401 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [200.60; 286.57] | J/mol×K | [401.39; 613.90] | 
|
| Cp,gas | 200.60 | J/mol×K | 401.39 | Joback Calculated Property |
| Cp,gas | 217.67 | J/mol×K | 436.81 | Joback Calculated Property |
| Cp,gas | 233.51 | J/mol×K | 472.23 | Joback Calculated Property |
| Cp,gas | 248.21 | J/mol×K | 507.65 | Joback Calculated Property |
| Cp,gas | 261.88 | J/mol×K | 543.07 | Joback Calculated Property |
| Cp,gas | 274.63 | J/mol×K | 578.48 | Joback Calculated Property |
| Cp,gas | 286.57 | J/mol×K | 613.90 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [283.78; 422.40] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.35516e+01 | |||
| Coefficient B | -3.01564e+03 | |||
| Coefficient C | -5.64260e+01 | |||
| Temperature range, min. | 283.78 | |||
| Temperature range, max. | 422.40 | |||
| Pvap | 1.33 | kPa | 283.78 | Calculated Property |
| Pvap | 3.09 | kPa | 299.18 | Calculated Property |
| Pvap | 6.49 | kPa | 314.58 | Calculated Property |
| Pvap | 12.53 | kPa | 329.99 | Calculated Property |
| Pvap | 22.54 | kPa | 345.39 | Calculated Property |
| Pvap | 38.23 | kPa | 360.79 | Calculated Property |
| Pvap | 61.61 | kPa | 376.19 | Calculated Property |
| Pvap | 95.03 | kPa | 391.60 | Calculated Property |
| Pvap | 141.11 | kPa | 407.00 | Calculated Property |
| Pvap | 202.66 | kPa | 422.40 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexene, 4,4-dimethyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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