- InChI
- InChI=1S/C6H11BrO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2/t5-,6+/m0/s1
- InChI Key
- AAMCLCZHZXKWRV-NTSWFWBYSA-N
- Formula
- C6H11BrO
- SMILES
- OC1CCCCC1Br
- Molecular Weight1
- 179.06
- CAS
- 16536-57-5
- Other Names
-
- cis-2-Bromocyclohexanol
- 2-Bromocyclohexanol, (Z)
- 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.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -242.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.93 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.685 | Crippen Calculated Property | |
| McVol | 107.910 | ml/mol | McGowan Calculated Property |
| Inp | 1089.00 | NIST | |
| Tboil | 484.60 | K | Relay (1.0) Calculated Property |
| Tfus | 301.80 ± 0.20 | 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.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [229.00; 294.47] | J/mol×K | [510.10; 721.05] | 
|
| Cp,gas | 229.00 | J/mol×K | 510.10 | Joback Calculated Property |
| Cp,gas | 241.63 | J/mol×K | 545.26 | Joback Calculated Property |
| Cp,gas | 253.54 | J/mol×K | 580.42 | Joback Calculated Property |
| Cp,gas | 264.76 | J/mol×K | 615.57 | Joback Calculated Property |
| Cp,gas | 275.31 | J/mol×K | 650.73 | Joback Calculated Property |
| Cp,gas | 285.20 | J/mol×K | 685.89 | Joback Calculated Property |
| Cp,gas | 294.47 | J/mol×K | 721.05 | Joback Calculated Property |
| η | [0.0002258; 0.0184055] | Pa×s | [281.14; 510.10] |
|
| η | 0.0184055 | Pa×s | 281.14 | Joback Calculated Property |
| η | 0.0057027 | Pa×s | 319.30 | Joback Calculated Property |
| η | 0.0022691 | Pa×s | 357.46 | Joback Calculated Property |
| η | 0.0010786 | Pa×s | 395.62 | Joback Calculated Property |
| η | 0.0005843 | Pa×s | 433.78 | Joback Calculated Property |
| η | 0.0003496 | Pa×s | 471.94 | Joback Calculated Property |
| η | 0.0002258 | Pa×s | 510.10 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 323.00 | K | 0.10 | NIST |
Similar Compounds
Find more compounds similar to Cyclohexanol, 2-bromo-, cis-.
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
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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