- InChI
- InChI=1S/C7H14O/c1-5-6-8-7(2,3)4/h5-6H,1-4H3
- InChI Key
- XGCRQUBGQPXCPL-AATRIKPKSA-N
- Formula
- C7H14O
- SMILES
- C/C=C/OC(C)(C)C
- Molecular Weight1
- 114.19
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tboil : Normal Boiling Point Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -259.43 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 7.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.41 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 2.335 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| Tboil | 368.38 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 | [205.33; 273.32] | J/mol×K | [383.11; 567.72] | 
|
| Cp,gas | 205.33 | J/mol×K | 383.11 | Joback Calculated Property |
| Cp,gas | 218.15 | J/mol×K | 413.88 | Joback Calculated Property |
| Cp,gas | 230.35 | J/mol×K | 444.65 | Joback Calculated Property |
| Cp,gas | 241.94 | J/mol×K | 475.41 | Joback Calculated Property |
| Cp,gas | 252.95 | J/mol×K | 506.18 | Joback Calculated Property |
| Cp,gas | 263.40 | J/mol×K | 536.95 | Joback Calculated Property |
| Cp,gas | 273.32 | J/mol×K | 567.72 | Joback Calculated Property |
| η | [0.0002060; 0.0070724] | Pa×s | [188.22; 383.11] |
|
| η | 0.0070724 | Pa×s | 188.22 | Joback Calculated Property |
| η | 0.0025424 | Pa×s | 220.70 | Joback Calculated Property |
| η | 0.0011883 | Pa×s | 253.18 | Joback Calculated Property |
| η | 0.0006603 | Pa×s | 285.67 | Joback Calculated Property |
| η | 0.0004136 | Pa×s | 318.15 | Joback Calculated Property |
| η | 0.0002826 | Pa×s | 350.63 | Joback Calculated Property |
| η | 0.0002060 | Pa×s | 383.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ether, tert-butyl propenyl, (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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