- InChI
- InChI=1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h6-9H,5H2,1-4H3/b10-6-
- InChI Key
- IOLQAHFPDADCHJ-POHAHGRESA-N
- Formula
- C10H18O
- SMILES
- CC(C)CC=C(C=O)C(C)C
- Molecular Weight1
- 154.25
- Other Names
-
- E-2-Hexenal, 5-methyl-2-(1-methylethyl)-
- 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).
- 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° | 0.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -238.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.84 | kJ/mol | Joback Calculated Property |
| log10WS | -2.66 | Crippen Calculated Property | |
| logPoct/wat | 2.814 | Crippen Calculated Property | |
| McVol | 149.030 | ml/mol | McGowan Calculated Property |
| Pc | 2424.27 | kPa | Joback Calculated Property |
| Tboil | 480.02 | K | Joback Calculated Property |
| Tc | 667.13 | K | Joback Calculated Property |
| Tfus | 195.42 | K | Joback Calculated Property |
| Vc | 0.582 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [326.28; 404.58] | J/mol×K | [480.02; 667.13] | 
|
| Cp,gas | 326.28 | J/mol×K | 480.02 | Joback Calculated Property |
| Cp,gas | 341.03 | J/mol×K | 511.21 | Joback Calculated Property |
| Cp,gas | 355.07 | J/mol×K | 542.39 | Joback Calculated Property |
| Cp,gas | 368.41 | J/mol×K | 573.58 | Joback Calculated Property |
| Cp,gas | 381.09 | J/mol×K | 604.76 | Joback Calculated Property |
| Cp,gas | 393.14 | J/mol×K | 635.95 | Joback Calculated Property |
| Cp,gas | 404.58 | J/mol×K | 667.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-5-Methyl-2-isopropyl-2-hexen-1-al.
Sources
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