- InChI
- InChI=1S/C10H14O/c1-5-6-9(4)10(7-11)8(2)3/h5-7H,1H2,2-4H3/b9-6+
- InChI Key
- NIEPGDUXTWPJLS-RMKNXTFCSA-N
- Formula
- C10H14O
- SMILES
- C=CC=C(C)C(C=O)=C(C)C
- Molecular Weight1
- 150.22
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | 156.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -4.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.06 | kJ/mol | Joback Calculated Property |
| log10WS | -2.85 | Crippen Calculated Property | |
| logPoct/wat | 2.654 | Crippen Calculated Property | |
| McVol | 140.430 | ml/mol | McGowan Calculated Property |
| Pc | 2648.83 | kPa | Joback Calculated Property |
| Inp | [1164.00; 1164.00] |
|
|
| Inp | 1164.00 | NIST | |
| Inp | 1164.00 | NIST | |
| Tboil | 481.50 | K | Joback Calculated Property |
| Tc | 680.24 | K | Joback Calculated Property |
| Tfus | 190.66 | K | Joback Calculated Property |
| Vc | 0.556 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [291.44; 361.15] | J/mol×K | [481.50; 680.24] |
|
| Cp,gas | 291.44 | J/mol×K | 481.50 | Joback Calculated Property |
| Cp,gas | 304.90 | J/mol×K | 514.62 | Joback Calculated Property |
| Cp,gas | 317.56 | J/mol×K | 547.75 | Joback Calculated Property |
| Cp,gas | 329.47 | J/mol×K | 580.87 | Joback Calculated Property |
| Cp,gas | 340.67 | J/mol×K | 613.99 | Joback Calculated Property |
| Cp,gas | 351.22 | J/mol×K | 647.12 | Joback Calculated Property |
| Cp,gas | 361.15 | J/mol×K | 680.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Isopropylidene-3-methylhexa-3,5-dienal.
Sources
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