- InChI
- InChI=1S/C6H12O/c1-5-3-2-4-6(5)7/h5-7H,2-4H2,1H3
- InChI Key
- BVIJQMCYYASIFP-UHFFFAOYSA-N
- Formula
- C6H12O
- SMILES
- CC1CCCC1O
- Molecular Weight1
- 100.16
- CAS
- 24070-77-7
- Other Names
-
- 2-Methylcyclopentanol
- 2-Methylcyclopentyl alcohol
- ω : Acentric Factor.
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- IE : Ionization energy (eV).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.4648 | Relay (1.0) Calculated Property | |
| ΔcH°liquid | -3744.00 | kJ/mol | NIST |
| ΔfG° | -108.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -264.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 10.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.57 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.167 | Crippen Calculated Property | |
| McVol | 90.410 | ml/mol | McGowan Calculated Property |
| Pc | 4135.61 | kPa | Joback Calculated Property |
| Tboil | [421.00; 424.00] | K |
|
| Tboil | 421.00 ± 3.00 | K | NIST |
| Tboil | 424.00 ± 6.00 | K | NIST |
| Tc | 623.87 | K | Relay (1.0) Calculated Property |
| Tfus | 223.51 | K | Relay (1.0) Calculated Property |
| Vc | 0.323 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [114.30; 337.50] | 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 | -5.18200e+01 | |||
| Coefficient B | 7.13020e-01 | |||
| Coefficient C | -4.05000e-04 | |||
| Coefficient D | 8.13000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 114.30 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 153.34 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 188.22 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 219.19 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 246.52 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 270.47 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 291.28 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 309.22 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 324.54 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 337.50 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0399340; 0.0002982] | Pa×s | [224.86; 438.87] |
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 | -1.32632e+01 | |||
| Coefficient B | 2.25820e+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. | 224.86 | |||
| Temperature range, max. | 438.87 | |||
| η | 0.0399340 | Pa×s | 224.86 | Calculated Property |
| η | 0.0152836 | Pa×s | 248.64 | Calculated Property |
| η | 0.0069171 | Pa×s | 272.42 | Calculated Property |
| η | 0.0035556 | Pa×s | 296.20 | Calculated Property |
| η | 0.0020177 | Pa×s | 319.98 | Calculated Property |
| η | 0.0012383 | Pa×s | 343.76 | Calculated Property |
| η | 0.0008096 | Pa×s | 367.53 | Calculated Property |
| η | 0.0005573 | Pa×s | 391.31 | Calculated Property |
| η | 0.0004004 | Pa×s | 415.09 | Calculated Property |
| η | 0.0002982 | Pa×s | 438.87 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanol, 2-methyl-.
Sources
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