- InChI
- InChI=1S/C8H12O2/c1-3-5-6-7-8(9)10-4-2/h3,5-7H,4H2,1-2H3
- InChI Key
- OZZYKXXGCOLLLO-UHFFFAOYSA-N
- Formula
- C8H12O2
- SMILES
- CC=CC=CC(=O)OCC
- Molecular Weight1
- 140.18
- 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.
- 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° | -57.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -218.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.47 | kJ/mol | Joback Calculated Property |
| log10WS | -1.74 | Crippen Calculated Property | |
| logPoct/wat | 1.682 | Crippen Calculated Property | |
| McVol | 122.420 | ml/mol | McGowan Calculated Property |
| Pc | 2966.57 | kPa | Joback Calculated Property |
| Inp | 1140.00 | NIST | |
| Tboil | 467.05 | K | Joback Calculated Property |
| Tc | 659.15 | K | Joback Calculated Property |
| Tfus | 241.92 | K | Joback Calculated Property |
| Vc | 0.468 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [246.65; 307.56] | J/mol×K | [467.05; 659.15] | 
|
| Cp,gas | 246.65 | J/mol×K | 467.05 | Joback Calculated Property |
| Cp,gas | 258.15 | J/mol×K | 499.07 | Joback Calculated Property |
| Cp,gas | 269.08 | J/mol×K | 531.08 | Joback Calculated Property |
| Cp,gas | 279.46 | J/mol×K | 563.10 | Joback Calculated Property |
| Cp,gas | 289.32 | J/mol×K | 595.12 | Joback Calculated Property |
| Cp,gas | 298.68 | J/mol×K | 627.13 | Joback Calculated Property |
| Cp,gas | 307.56 | J/mol×K | 659.15 | Joback Calculated Property |
| η | [0.0001776; 0.0028027] | Pa×s | [241.92; 467.05] |
|
| η | 0.0028027 | Pa×s | 241.92 | Joback Calculated Property |
| η | 0.0012997 | Pa×s | 279.44 | Joback Calculated Property |
| η | 0.0007230 | Pa×s | 316.96 | Joback Calculated Property |
| η | 0.0004553 | Pa×s | 354.49 | Joback Calculated Property |
| η | 0.0003133 | Pa×s | 392.01 | Joback Calculated Property |
| η | 0.0002301 | Pa×s | 429.53 | Joback Calculated Property |
| η | 0.0001776 | Pa×s | 467.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl 2,4-dimethyl-2,4-hexadienoate, not E,E, # 1.
Sources
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