- InChI
- InChI=1S/C14H22O/c1-10-6-5-7-14(4)9-13(2,3)12(15)8-11(10)14/h8,10H,5-7,9H2,1-4H3/t10-,14+/m0/s1
- InChI Key
- FNKVHQVJAQMJDF-IINYFYTJSA-N
- Formula
- C14H22O
- SMILES
- CC1CCCC2(C)CC(C)(C)C(=O)C=C12
- Molecular Weight1
- 206.32
- 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° | 19.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -292.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.86 | kJ/mol | Joback Calculated Property |
| log10WS | -3.88 | Crippen Calculated Property | |
| logPoct/wat | 3.738 | Crippen Calculated Property | |
| McVol | 183.670 | ml/mol | McGowan Calculated Property |
| Pc | 2291.52 | kPa | Joback Calculated Property |
| Inp | 1620.00 | NIST | |
| Tboil | 618.05 | K | Joback Calculated Property |
| Tc | 860.99 | K | Joback Calculated Property |
| Tfus | 394.40 | K | Joback Calculated Property |
| Vc | 0.690 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [506.50; 626.68] | J/mol×K | [618.05; 860.99] | 
|
| Cp,gas | 506.50 | J/mol×K | 618.05 | Joback Calculated Property |
| Cp,gas | 528.58 | J/mol×K | 658.54 | Joback Calculated Property |
| Cp,gas | 549.48 | J/mol×K | 699.03 | Joback Calculated Property |
| Cp,gas | 569.47 | J/mol×K | 739.52 | Joback Calculated Property |
| Cp,gas | 588.83 | J/mol×K | 780.01 | Joback Calculated Property |
| Cp,gas | 607.81 | J/mol×K | 820.50 | Joback Calculated Property |
| Cp,gas | 626.68 | J/mol×K | 860.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 11,12,13-tris-nor-8,8-Dimethyleudesm-5-en-7-one.
Sources
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