- InChI
- InChI=1S/C8H16O/c1-7(9)8-5-3-2-4-6-8/h7-9H,2-6H2,1H3/t7-/m1/s1
- InChI Key
- JMSUNAQVHOHLMX-SSDOTTSWSA-N
- Formula
- C8H16O
- SMILES
- CC(O)C1CCCCC1
- Molecular Weight1
- 128.21
- CAS
- 3113-98-2
- ω : Acentric Factor.
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.5013 | Relay (... Calculated Property | |
| ΔfG° | -98.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -332.77 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 8.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.86 | kJ/mol | Relay (... Calculated Property |
| IE | 9.63 | eV | Relay (... Calculated Property |
| log10WS | -1.54 | Relay (... Calculated Property | |
| logPoct/wat | 1.948 | Crippen Calculated Property | |
| McVol | 118.590 | ml/mol | McGowan Calculated Property |
| Pc | 3538.87 | kPa | Joback Calculated Property |
| Tboil | 460.28 | K | Relay (... Calculated Property |
| Tc | 670.21 | K | Relay (... Calculated Property |
| Tfus | 290.04 | K | Relay (... Calculated Property |
| Vc | 0.411 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [274.89; 355.28] | J/mol×K | [493.73; 688.47] | 
|
| Cp,gas | 274.89 | J/mol×K | 493.73 | Joback Calculated Property |
| Cp,gas | 290.13 | J/mol×K | 526.19 | Joback Calculated Property |
| Cp,gas | 304.61 | J/mol×K | 558.64 | Joback Calculated Property |
| Cp,gas | 318.34 | J/mol×K | 591.10 | Joback Calculated Property |
| Cp,gas | 331.35 | J/mol×K | 623.56 | Joback Calculated Property |
| Cp,gas | 343.66 | J/mol×K | 656.01 | Joback Calculated Property |
| Cp,gas | 355.28 | J/mol×K | 688.47 | Joback Calculated Property |
| η | [0.0001648; 0.1298212] | Pa×s | [233.12; 493.73] |
|
| η | 0.1298212 | Pa×s | 233.12 | Joback Calculated Property |
| η | 0.0178461 | Pa×s | 276.56 | Joback Calculated Property |
| η | 0.0042044 | Pa×s | 319.99 | Joback Calculated Property |
| η | 0.0013994 | Pa×s | 363.42 | Joback Calculated Property |
| η | 0.0005891 | Pa×s | 406.86 | Joback Calculated Property |
| η | 0.0002930 | Pa×s | 450.29 | Joback Calculated Property |
| η | 0.0001648 | Pa×s | 493.73 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [355.70; 378.20] | K | [1.60; 4.70] |
|
| Tboilr | 355.70 | K | 1.60 | NIST |
| Tboilr | 378.20 | K | 4.70 | NIST |
Similar Compounds
Find more compounds similar to Cyclohexanemethanol, «alpha»-methyl-, (S)-.
Sources
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