- InChI
- InChI=1S/C8H12O2/c1-2-4-7-8(10-7)5-3-6-9/h3,5-8H,2,4H2,1H3/b5-3+/t7-,8-/m0/s1
- InChI Key
- RBBPXPMPGIPSJY-VKTMEOEOSA-N
- Formula
- C8H12O2
- SMILES
- CCCC1OC1C=CC=O
- Molecular Weight1
- 140.18
- Other Names
-
- trans-4,5-epoxy-(E)-oct-2-enal
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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.
- 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 |
|---|---|---|---|
| ω | 0.4069 | Relay (1.0) Calculated Property | |
| ΔfG° | -35.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -232.64 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.32 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.96 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.309 | Crippen Calculated Property | |
| McVol | 115.860 | ml/mol | McGowan Calculated Property |
| Pc | 3184.73 | kPa | Joback Calculated Property |
| Inp | [1181.00; 1181.00] |
|
|
| Inp | 1181.00 | NIST | |
| Inp | 1181.00 | NIST | |
| Tboil | 463.90 | K | Relay (1.0) Calculated Property |
| Tc | 657.04 | K | Relay (1.0) Calculated Property |
| Tfus | 259.96 | K | Relay (1.0) Calculated Property |
| Vc | 0.419 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [255.71; 322.47] | J/mol×K | [464.28; 657.51] |
|
| Cp,gas | 255.71 | J/mol×K | 464.28 | Joback Calculated Property |
| Cp,gas | 268.54 | J/mol×K | 496.49 | Joback Calculated Property |
| Cp,gas | 280.64 | J/mol×K | 528.69 | Joback Calculated Property |
| Cp,gas | 292.05 | J/mol×K | 560.90 | Joback Calculated Property |
| Cp,gas | 302.79 | J/mol×K | 593.10 | Joback Calculated Property |
| Cp,gas | 312.92 | J/mol×K | 625.31 | Joback Calculated Property |
| Cp,gas | 322.47 | J/mol×K | 657.51 | Joback Calculated Property |
| η | [0.0005394; 0.0018048] | Pa×s | [257.11; 464.28] |
|
| η | 0.0018048 | Pa×s | 257.11 | Joback Calculated Property |
| η | 0.0013099 | Pa×s | 291.64 | Joback Calculated Property |
| η | 0.0010175 | Pa×s | 326.17 | Joback Calculated Property |
| η | 0.0008295 | Pa×s | 360.69 | Joback Calculated Property |
| η | 0.0007009 | Pa×s | 395.22 | Joback Calculated Property |
| η | 0.0006084 | Pa×s | 429.75 | Joback Calculated Property |
| η | 0.0005394 | Pa×s | 464.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E)-4,5-epoxy-(E)-2-octenal.
Sources
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