![4,8-Dimethylbicyclo[3.3.1]nonane-2,6-dione](/cid/87-068-1/4-8-Dimethylbicyclo-3-3-1-nonane-2-6-dione.png "4,8-Dimethylbicyclo[3.3.1]nonane-2,6-dione")
- InChI
- InChI=1S/C11H16O2/c1-6-3-10(12)9-5-8(6)11(13)4-7(9)2/h6-9H,3-5H2,1-2H3
- InChI Key
- OTBXXMWIANCGFF-UHFFFAOYSA-N
- Formula
- C11H16O2
- SMILES
- CC1CC(=O)C2CC1C(=O)CC2C
- Molecular Weight1
- 180.24
- CAS
- 139914-54-8
- Other Names
-
- 4,8-Dimethylbicyclo[3.3.1]nona-2,6-dione
- 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).
- IE : Ionization energy (eV).
- 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° | -133.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -459.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.30 | kJ/mol | Joback Calculated Property |
| IE | 9.22 | eV | NIST |
| log10WS | -1.81 | Crippen Calculated Property | |
| logPoct/wat | 1.827 | Crippen Calculated Property | |
| McVol | 147.270 | ml/mol | McGowan Calculated Property |
| Pc | 2670.78 | kPa | Joback Calculated Property |
| Tboil | 603.67 | K | Joback Calculated Property |
| Tc | 844.01 | K | Joback Calculated Property |
| Tfus | 367.01 | K | Joback Calculated Property |
| Vc | 0.553 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [411.77; 518.93] | J/mol×K | [603.67; 844.01] | 
|
| Cp,gas | 411.77 | J/mol×K | 603.67 | Joback Calculated Property |
| Cp,gas | 432.75 | J/mol×K | 643.73 | Joback Calculated Property |
| Cp,gas | 452.52 | J/mol×K | 683.78 | Joback Calculated Property |
| Cp,gas | 471.04 | J/mol×K | 723.84 | Joback Calculated Property |
| Cp,gas | 488.29 | J/mol×K | 763.90 | Joback Calculated Property |
| Cp,gas | 504.27 | J/mol×K | 803.96 | Joback Calculated Property |
| Cp,gas | 518.93 | J/mol×K | 844.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,8-Dimethylbicyclo[3.3.1]nonane-2,6-dione.
Sources
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