- InChI
- InChI=1S/C9H14O2/c1-2-3-5-8-9(11-8)6-4-7-10/h4,6-9H,2-3,5H2,1H3/b6-4+/t8-,9-/m0/s1
- InChI Key
- JQNFKXWEJORMGJ-AIZLHNLISA-N
- Formula
- C9H14O2
- SMILES
- CCCCC1OC1C=CC=O
- Molecular Weight1
- 154.21
- Other Names
-
- (E)-4,5-epoxy-(E)-2-nonenal
- tr-4,5-Epoxy-(E)-2- nonenal
- trans-4,5-epoxy-(E)-non-2-enal
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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° | -27.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -276.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.42 | kJ/mol | Joback Calculated Property |
| log10WS | -1.93 | Crippen Calculated Property | |
| logPoct/wat | 1.699 | Crippen Calculated Property | |
| McVol | 129.950 | ml/mol | McGowan Calculated Property |
| Pc | 2865.80 | kPa | Joback Calculated Property |
| Inp | [1245.00; 1280.00] |
|
|
| Inp | 1245.00 | NIST | |
| Inp | 1245.00 | NIST | |
| Inp | 1279.00 | NIST | |
| Inp | 1280.00 | NIST | |
| Inp | 1245.00 | NIST | |
| I | [1876.00; 1902.00] |
|
|
| I | 1884.00 | NIST | |
| I | 1876.00 | NIST | |
| I | 1902.00 | NIST | |
| Tboil | 487.16 | K | Joback Calculated Property |
| Tc | 678.18 | K | Joback Calculated Property |
| Tfus | 268.38 | K | Joback Calculated Property |
| Vc | 0.513 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [298.74; 370.52] | J/mol×K | [487.16; 678.18] |
|
| Cp,gas | 298.74 | J/mol×K | 487.16 | Joback Calculated Property |
| Cp,gas | 312.48 | J/mol×K | 519.00 | Joback Calculated Property |
| Cp,gas | 325.46 | J/mol×K | 550.83 | Joback Calculated Property |
| Cp,gas | 337.71 | J/mol×K | 582.67 | Joback Calculated Property |
| Cp,gas | 349.28 | J/mol×K | 614.51 | Joback Calculated Property |
| Cp,gas | 360.21 | J/mol×K | 646.34 | Joback Calculated Property |
| Cp,gas | 370.52 | J/mol×K | 678.18 | Joback Calculated Property |
| η | [0.0005499; 0.0020626] | Pa×s | [268.38; 487.16] |
|
| η | 0.0020626 | Pa×s | 268.38 | Joback Calculated Property |
| η | 0.0014504 | Pa×s | 304.84 | Joback Calculated Property |
| η | 0.0010996 | Pa×s | 341.31 | Joback Calculated Property |
| η | 0.0008794 | Pa×s | 377.77 | Joback Calculated Property |
| η | 0.0007316 | Pa×s | 414.23 | Joback Calculated Property |
| η | 0.0006269 | Pa×s | 450.70 | Joback Calculated Property |
| η | 0.0005499 | Pa×s | 487.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-4,5-epoxy-(E)-2-nonenal.
Sources
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