- InChI
- InChI=1S/C8H16O/c1-6-3-7(2)5-8(9)4-6/h6-9H,3-5H2,1-2H3
- InChI Key
- WIYNOPYNRFPWNB-UHFFFAOYSA-N
- Formula
- C8H16O
- SMILES
- CC1CC(C)CC(O)C1
- Molecular Weight1
- 128.21
- CAS
- 5441-52-1
- Other Names
-
- 3,5-Dimethylcyclohexanol
- 3,5-Dimethylcyclohexanol,c&t
- 3,5-dimethylcyclohexan-1-ol
- 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).
- 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 |
|---|---|---|---|
| ω | 0.4763 | Relay (1.0) Calculated Property | |
| ΔcH°liquid | -4990.70 | kJ/mol | NIST |
| ΔfG° | -111.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -350.73 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.20 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.15 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.803 | Crippen Calculated Property | |
| McVol | 118.590 | ml/mol | McGowan Calculated Property |
| Pc | 3246.73 | kPa | Joback Calculated Property |
| Inp | [972.00; 974.00] |
|
|
| Inp | 972.00 | NIST | |
| Inp | 974.00 | NIST | |
| I | 1809.00 | NIST | |
| Tboil | 458.70 | K | NIST |
| Tc | 647.44 | K | Relay (1.0) Calculated Property |
| Tfus | 286.59 | K | Relay (1.0) Calculated Property |
| Vc | 0.425 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.01; 359.03] | J/mol×K | [484.83; 674.82] |
|
| Cp,gas | 276.01 | J/mol×K | 484.83 | Joback Calculated Property |
| Cp,gas | 291.52 | J/mol×K | 516.49 | Joback Calculated Property |
| Cp,gas | 306.35 | J/mol×K | 548.16 | Joback Calculated Property |
| Cp,gas | 320.50 | J/mol×K | 579.82 | Joback Calculated Property |
| Cp,gas | 334.00 | J/mol×K | 611.49 | Joback Calculated Property |
| Cp,gas | 346.84 | J/mol×K | 643.15 | Joback Calculated Property |
| Cp,gas | 359.03 | J/mol×K | 674.82 | Joback Calculated Property |
| η | [0.0002017; 0.0327662] | Pa×s | [239.64; 484.83] |
|
| η | 0.0327662 | Pa×s | 239.64 | Joback Calculated Property |
| η | 0.0075606 | Pa×s | 280.50 | Joback Calculated Property |
| η | 0.0025331 | Pa×s | 321.37 | Joback Calculated Property |
| η | 0.0010862 | Pa×s | 362.24 | Joback Calculated Property |
| η | 0.0005530 | Pa×s | 403.10 | Joback Calculated Property |
| η | 0.0003188 | Pa×s | 443.97 | Joback Calculated Property |
| η | 0.0002017 | Pa×s | 484.83 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [353.12; 483.35] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.62696e+01 | |||
| Coefficient B | -4.53965e+03 | |||
| Coefficient C | -6.90720e+01 | |||
| Temperature range, min. | 353.12 | |||
| Temperature range, max. | 483.35 | |||
| Pvap | 1.33 | kPa | 353.12 | Calculated Property |
| Pvap | 2.89 | kPa | 367.59 | Calculated Property |
| Pvap | 5.84 | kPa | 382.06 | Calculated Property |
| Pvap | 11.09 | kPa | 396.53 | Calculated Property |
| Pvap | 19.94 | kPa | 411.00 | Calculated Property |
| Pvap | 34.19 | kPa | 425.47 | Calculated Property |
| Pvap | 56.20 | kPa | 439.94 | Calculated Property |
| Pvap | 89.00 | kPa | 454.41 | Calculated Property |
| Pvap | 136.32 | kPa | 468.88 | Calculated Property |
| Pvap | 202.67 | kPa | 483.35 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanol, 3,5-dimethyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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