- InChI
- InChI=1S/C10H16O/c1-5-9(4)7-10(11)6-8(2)3/h5,8H,1,4,6-7H2,2-3H3
- InChI Key
- IAUTWQNZPYUFQE-UHFFFAOYSA-N
- Formula
- C10H16O
- SMILES
- C=CC(=C)CC(=O)CC(C)C
- Molecular Weight1
- 152.23
- CAS
- 19860-68-5
- 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° | 69.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -126.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.95 | kJ/mol | Joback Calculated Property |
| log10WS | -2.75 | Crippen Calculated Property | |
| logPoct/wat | 2.734 | Crippen Calculated Property | |
| McVol | 144.730 | ml/mol | McGowan Calculated Property |
| Pc | 2455.60 | kPa | Joback Calculated Property |
| Inp | 1083.00 | NIST | |
| Tboil | 474.87 | K | Joback Calculated Property |
| Tc | 661.71 | K | Joback Calculated Property |
| Tfus | 219.91 | K | Joback Calculated Property |
| Vc | 0.558 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [307.00; 380.83] | J/mol×K | [474.87; 661.71] | 
|
| Cp,gas | 307.00 | J/mol×K | 474.87 | Joback Calculated Property |
| Cp,gas | 320.91 | J/mol×K | 506.01 | Joback Calculated Property |
| Cp,gas | 334.15 | J/mol×K | 537.15 | Joback Calculated Property |
| Cp,gas | 346.73 | J/mol×K | 568.29 | Joback Calculated Property |
| Cp,gas | 358.69 | J/mol×K | 599.43 | Joback Calculated Property |
| Cp,gas | 370.05 | J/mol×K | 630.57 | Joback Calculated Property |
| Cp,gas | 380.83 | J/mol×K | 661.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-6-methyleneoct-7-en-4-one.
Sources
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