- InChI
- InChI=1S/C7H14O/c1-6(8)7-4-2-3-5-7/h6-8H,2-5H2,1H3
- InChI Key
- WPCMSUSLCWXTKB-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- CC(O)C1CCCC1
- Molecular Weight1
- 114.19
- Other Names
-
- 1-Cyclopentylethanol
- «alpha»-methylcyclopentanemethanol
- ω : Acentric Factor.
- 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).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical 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 |
|---|---|---|---|
| ω | 0.5037 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -301.49 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 8.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.49 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.60 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 1.557 | Crippen Calculated Property | |
| McVol | 104.500 | ml/mol | McGowan Calculated Property |
| Pc | 3857.88 | kPa | Joback Calculated Property |
| Tboil | 439.21 | K | Relay (1.0) Calculated Property |
| Tc | 643.56 | K | Relay (1.0) Calculated Property |
| Tfus | 257.11 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, 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 | [132.94; 382.97] | 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 | -6.03500e+01 | |||
| Coefficient B | 8.40420e-01 | |||
| Coefficient C | -5.18000e-04 | |||
| Coefficient D | 1.20900e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 132.94 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 177.49 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 216.96 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 251.73 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 282.17 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 308.68 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 331.63 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 351.41 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 368.39 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 382.97 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.1013136; 0.0002596] | Pa×s | [225.37; 459.74] |
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 | -1.39942e+01 | |||
| Coefficient B | 2.63787e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 225.37 | |||
| Temperature range, max. | 459.74 | |||
| η | 0.1013136 | Pa×s | 225.37 | Calculated Property |
| η | 0.0301408 | Pa×s | 251.41 | Calculated Property |
| η | 0.0112583 | Pa×s | 277.45 | Calculated Property |
| η | 0.0049795 | Pa×s | 303.49 | Calculated Property |
| η | 0.0025055 | Pa×s | 329.53 | Calculated Property |
| η | 0.0013941 | Pa×s | 355.57 | Calculated Property |
| η | 0.0008403 | Pa×s | 381.61 | Calculated Property |
| η | 0.0005403 | Pa×s | 407.65 | Calculated Property |
| η | 0.0003664 | Pa×s | 433.70 | Calculated Property |
| η | 0.0002596 | Pa×s | 459.74 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanemethanol, .alpha.-methyl-.
Sources
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