- InChI
- InChI=1S/C6H11ClO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2
- InChI Key
- NYEWDMNOXFGGDX-UHFFFAOYSA-N
- Formula
- C6H11ClO
- SMILES
- OC1CCCCC1Cl
- Molecular Weight1
- 134.60
- CAS
- 1561-86-0
- Other Names
-
- Cyclohexanol, 2-chloro-
- 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).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| ΔfH°gas | -314.15 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.11 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.529 | Crippen Calculated Property | |
| McVol | 102.650 | ml/mol | McGowan Calculated Property |
| Inp | [1017.00; 1032.10] |
|
|
| Inp | 1032.10 | NIST | |
| Inp | 1017.00 | NIST | |
| Inp | 1017.00 | NIST | |
| I | [1629.00; 1659.00] |
|
|
| I | 1629.00 | NIST | |
| I | 1658.00 | NIST | |
| I | 1658.00 | NIST | |
| I | 1659.00 | NIST | |
| I | 1629.00 | NIST | |
| Tboil | 470.21 | K | Relay (1.0) Calculated Property |
| Tfus | 293.07 | 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.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [216.74; 283.25] | J/mol×K | [481.37; 682.23] |
|
| Cp,gas | 216.74 | J/mol×K | 481.37 | Joback Calculated Property |
| Cp,gas | 229.38 | J/mol×K | 514.85 | Joback Calculated Property |
| Cp,gas | 241.38 | J/mol×K | 548.32 | Joback Calculated Property |
| Cp,gas | 252.75 | J/mol×K | 581.80 | Joback Calculated Property |
| Cp,gas | 263.51 | J/mol×K | 615.28 | Joback Calculated Property |
| Cp,gas | 273.67 | J/mol×K | 648.75 | Joback Calculated Property |
| Cp,gas | 283.25 | J/mol×K | 682.23 | Joback Calculated Property |
| η | [0.0002316; 0.0353626] | Pa×s | [251.26; 481.37] |
|
| η | 0.0353626 | Pa×s | 251.26 | Joback Calculated Property |
| η | 0.0087823 | Pa×s | 289.61 | Joback Calculated Property |
| η | 0.0030210 | Pa×s | 327.96 | Joback Calculated Property |
| η | 0.0012994 | Pa×s | 366.32 | Joback Calculated Property |
| η | 0.0006558 | Pa×s | 404.67 | Joback Calculated Property |
| η | 0.0003726 | Pa×s | 443.02 | Joback Calculated Property |
| η | 0.0002316 | Pa×s | 481.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chlorocyclohexanol.
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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