- InChI
- InChI=1S/C7H14O/c1-4-5-7(8)6(2)3/h4,6-8H,1,5H2,2-3H3
- InChI Key
- JKGMJZOZIJHPOH-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- C=CCC(O)C(C)C
- Molecular Weight1
- 114.19
- CAS
- 32815-70-6
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -45.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -225.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.41 | kJ/mol | Joback Calculated Property |
| log10WS | -1.74 | Crippen Calculated Property | |
| logPoct/wat | 1.579 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| Pc | 3302.95 | kPa | Joback Calculated Property |
| Tboil | 447.54 | K | Joback Calculated Property |
| Tc | 617.97 | K | Joback Calculated Property |
| Tfus | 197.71 | K | Joback Calculated Property |
| Vc | 0.415 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [231.69; 288.79] | J/mol×K | [447.54; 617.97] | 
|
| Cp,gas | 231.69 | J/mol×K | 447.54 | Joback Calculated Property |
| Cp,gas | 242.28 | J/mol×K | 475.95 | Joback Calculated Property |
| Cp,gas | 252.42 | J/mol×K | 504.35 | Joback Calculated Property |
| Cp,gas | 262.13 | J/mol×K | 532.76 | Joback Calculated Property |
| Cp,gas | 271.42 | J/mol×K | 561.16 | Joback Calculated Property |
| Cp,gas | 280.30 | J/mol×K | 589.57 | Joback Calculated Property |
| Cp,gas | 288.79 | J/mol×K | 617.97 | Joback Calculated Property |
| η | [0.0001969; 0.4022587] | Pa×s | [197.71; 447.54] |
|
| η | 0.4022587 | Pa×s | 197.71 | Joback Calculated Property |
| η | 0.0374006 | Pa×s | 239.35 | Joback Calculated Property |
| η | 0.0070307 | Pa×s | 280.99 | Joback Calculated Property |
| η | 0.0020346 | Pa×s | 322.62 | Joback Calculated Property |
| η | 0.0007818 | Pa×s | 364.26 | Joback Calculated Property |
| η | 0.0003655 | Pa×s | 405.90 | Joback Calculated Property |
| η | 0.0001969 | Pa×s | 447.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-5-hexen-3-ol.
Sources
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