- InChI
- InChI=1S/C7H14O/c1-6-4-2-3-5-7(6)8/h6-8H,2-5H2,1H3/t6-,7-/m0/s1
- InChI Key
- NDVWOBYBJYUSMF-BQBZGAKWSA-N
- Formula
- C7H14O
- SMILES
- CC1CCCCC1O
- Molecular Weight1
- 114.19
- CAS
- 7443-52-9
- Other Names
-
- trans-2-Methylcyclohexanol
- 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).
- ΔfH°liquid : Liquid phase 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ΔcH°liquid | [-4334.20; -4322.20] | kJ/mol |
|
| ΔcH°liquid | -4322.20 ± 3.30 | kJ/mol | NIST |
| ΔcH°liquid | -4334.20 ± 3.30 | kJ/mol | NIST |
| ΔfG° | -112.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -306.06 | kJ/mol | Joback Calculated Property |
| ΔfH°liquid | -421.25 | kJ/mol | NIST |
| ΔfusH° | 10.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.97 | kJ/mol | Joback Calculated Property |
| log10WS | -1.78 | Crippen Calculated Property | |
| logPoct/wat | 1.557 | Crippen Calculated Property | |
| McVol | 104.500 | ml/mol | McGowan Calculated Property |
| Pc | 3782.33 | kPa | Joback Calculated Property |
| Inp | 946.00 | NIST | |
| I | [1409.00; 1438.00] |
|
|
| I | 1409.00 | NIST | |
| I | 1438.00 | NIST | |
| Tboil | 440.60 | K | NIST |
| Tc | 659.09 | K | Joback Calculated Property |
| Tfus | 232.61 | K | Joback Calculated Property |
| Vc | 0.379 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [231.22; 307.10] | J/mol×K | [466.62; 659.09] |
|
| Cp,gas | 231.22 | J/mol×K | 466.62 | Joback Calculated Property |
| Cp,gas | 245.46 | J/mol×K | 498.70 | Joback Calculated Property |
| Cp,gas | 259.05 | J/mol×K | 530.78 | Joback Calculated Property |
| Cp,gas | 271.99 | J/mol×K | 562.86 | Joback Calculated Property |
| Cp,gas | 284.31 | J/mol×K | 594.94 | Joback Calculated Property |
| Cp,gas | 296.01 | J/mol×K | 627.01 | Joback Calculated Property |
| Cp,gas | 307.10 | J/mol×K | 659.09 | Joback Calculated Property |
| η | [0.0002179; 0.0550246] | Pa×s | [232.61; 466.62] |
|
| η | 0.0550246 | Pa×s | 232.61 | Joback Calculated Property |
| η | 0.0112900 | Pa×s | 271.61 | Joback Calculated Property |
| η | 0.0034480 | Pa×s | 310.61 | Joback Calculated Property |
| η | 0.0013721 | Pa×s | 349.62 | Joback Calculated Property |
| η | 0.0006569 | Pa×s | 388.62 | Joback Calculated Property |
| η | 0.0003597 | Pa×s | 427.62 | Joback Calculated Property |
| η | 0.0002179 | Pa×s | 466.62 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [337.12; 464.90] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.60691e+01 | |||
| Coefficient B | -4.31795e+03 | |||
| Coefficient C | -6.35120e+01 | |||
| Temperature range, min. | 337.12 | |||
| Temperature range, max. | 464.90 | |||
| Pvap | 1.33 | kPa | 337.12 | Calculated Property |
| Pvap | 2.90 | kPa | 351.32 | Calculated Property |
| Pvap | 5.88 | kPa | 365.52 | Calculated Property |
| Pvap | 11.17 | kPa | 379.71 | Calculated Property |
| Pvap | 20.09 | kPa | 393.91 | Calculated Property |
| Pvap | 34.42 | kPa | 408.11 | Calculated Property |
| Pvap | 56.52 | kPa | 422.31 | Calculated Property |
| Pvap | 89.35 | kPa | 436.50 | Calculated Property |
| Pvap | 136.61 | kPa | 450.70 | Calculated Property |
| Pvap | 202.67 | kPa | 464.90 | Calculated Property |
| Pvap | [0.02; 3767.15] | kPa | [269.15; 616.00] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 7.61143e+01 | |||
| Coefficient B | -8.61631e+03 | |||
| Coefficient C | -8.68733e+00 | |||
| Coefficient D | 5.02864e-06 | |||
| Temperature range, min. | 269.15 | |||
| Temperature range, max. | 616.00 | |||
| Pvap | 0.02 | kPa | 269.15 | Calculated Property |
| Pvap | 0.31 | kPa | 307.69 | Calculated Property |
| Pvap | 2.82 | kPa | 346.23 | Calculated Property |
| Pvap | 15.68 | kPa | 384.77 | Calculated Property |
| Pvap | 61.48 | kPa | 423.31 | Calculated Property |
| Pvap | 187.14 | kPa | 461.84 | Calculated Property |
| Pvap | 472.94 | kPa | 500.38 | Calculated Property |
| Pvap | 1040.22 | kPa | 538.92 | Calculated Property |
| Pvap | 2060.14 | kPa | 577.46 | Calculated Property |
| Pvap | 3767.15 | kPa | 616.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanol, 2-methyl-, trans-.
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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