- InChI
- InChI=1S/C8H16O/c1-4-9-7-5-6-8(2)3/h5,7-8H,4,6H2,1-3H3/b7-5+
- InChI Key
- PEGWCMWUBAGRKQ-FNORWQNLSA-N
- Formula
- C8H16O
- SMILES
- CCOC=CCC(C)C
- Molecular Weight1
- 128.21
- CAS
- 16969-14-5
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 14.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.34 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.583 | Crippen Calculated Property | |
| McVol | 125.150 | ml/mol | McGowan Calculated Property |
| Tboil | 397.41 | K | Relay (1.0) Calculated Property |
| Tfus | 195.91 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [242.63; 312.81] | J/mol×K | [408.58; 584.62] | 
|
| Cp,gas | 242.63 | J/mol×K | 408.58 | Joback Calculated Property |
| Cp,gas | 255.52 | J/mol×K | 437.92 | Joback Calculated Property |
| Cp,gas | 267.93 | J/mol×K | 467.26 | Joback Calculated Property |
| Cp,gas | 279.84 | J/mol×K | 496.60 | Joback Calculated Property |
| Cp,gas | 291.29 | J/mol×K | 525.94 | Joback Calculated Property |
| Cp,gas | 302.28 | J/mol×K | 555.28 | Joback Calculated Property |
| Cp,gas | 312.81 | J/mol×K | 584.62 | Joback Calculated Property |
| η | [0.0001752; 0.0067640] | Pa×s | [182.07; 408.58] |
|
| η | 0.0067640 | Pa×s | 182.07 | Joback Calculated Property |
| η | 0.0021811 | Pa×s | 219.82 | Joback Calculated Property |
| η | 0.0009800 | Pa×s | 257.57 | Joback Calculated Property |
| η | 0.0005403 | Pa×s | 295.32 | Joback Calculated Property |
| η | 0.0003409 | Pa×s | 333.08 | Joback Calculated Property |
| η | 0.0002362 | Pa×s | 370.83 | Joback Calculated Property |
| η | 0.0001752 | Pa×s | 408.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ether, ethyl 4-methyl-1-pentyl, (E).
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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