- InChI
- InChI=1S/C7H14O/c1-5(2)7(8)6(3)4/h6-8H,1H2,2-4H3
- InChI Key
- DWLSOADTNMPXFH-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- C=C(C)C(O)C(C)C
- Molecular Weight1
- 114.19
- CAS
- 19781-54-5
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -54.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -234.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.49 | 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 | 3322.01 | kPa | Joback Calculated Property |
| Tboil | 447.42 | K | Joback Calculated Property |
| Tc | 620.97 | K | Joback Calculated Property |
| Tfus | 183.75 | K | Joback Calculated Property |
| Vc | 0.416 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [231.62; 289.47] | J/mol×K | [447.42; 620.97] | 
|
| Cp,gas | 231.62 | J/mol×K | 447.42 | Joback Calculated Property |
| Cp,gas | 242.37 | J/mol×K | 476.34 | Joback Calculated Property |
| Cp,gas | 252.65 | J/mol×K | 505.27 | Joback Calculated Property |
| Cp,gas | 262.49 | J/mol×K | 534.19 | Joback Calculated Property |
| Cp,gas | 271.90 | J/mol×K | 563.12 | Joback Calculated Property |
| Cp,gas | 280.89 | J/mol×K | 592.04 | Joback Calculated Property |
| Cp,gas | 289.47 | J/mol×K | 620.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dimethyl-1-penten-3-ol.
Sources
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