- InChI
- InChI=1S/C10H16O/c1-4-9(2)7-5-6-8-10(3)11/h4,7H,1,5-6,8H2,2-3H3/b9-7+
- InChI Key
- KNSKAJBEVXTBQM-VQHVLOKHSA-N
- Formula
- C10H16O
- SMILES
- C=CC(C)=CCCCC(C)=O
- Molecular Weight1
- 152.23
- 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° | 63.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -129.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.97 | kJ/mol | Joback Calculated Property |
| log10WS | -3.00 | Crippen Calculated Property | |
| logPoct/wat | 2.878 | Crippen Calculated Property | |
| McVol | 144.730 | ml/mol | McGowan Calculated Property |
| Pc | 2460.47 | kPa | Joback Calculated Property |
| Inp | 1159.00 | NIST | |
| Tboil | 482.79 | K | Joback Calculated Property |
| Tc | 670.35 | K | Joback Calculated Property |
| Tfus | 231.59 | K | Joback Calculated Property |
| Vc | 0.564 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [307.54; 380.33] | J/mol×K | [482.79; 670.35] | 
|
| Cp,gas | 307.54 | J/mol×K | 482.79 | Joback Calculated Property |
| Cp,gas | 321.31 | J/mol×K | 514.05 | Joback Calculated Property |
| Cp,gas | 334.38 | J/mol×K | 545.31 | Joback Calculated Property |
| Cp,gas | 346.79 | J/mol×K | 576.57 | Joback Calculated Property |
| Cp,gas | 358.57 | J/mol×K | 607.83 | Joback Calculated Property |
| Cp,gas | 369.74 | J/mol×K | 639.09 | Joback Calculated Property |
| Cp,gas | 380.33 | J/mol×K | 670.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Methyl-6,8-nonadien-2-one.
Sources
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