- InChI
- InChI=1S/C15H22O/c1-11(2)14-8-5-12(3)6-10-15(16)13(4)7-9-14/h5,14H,1,4,6-10H2,2-3H3/b12-5+
- InChI Key
- QMEZKUJMSSOSEF-LFYBBSHMSA-N
- Formula
- C15H22O
- SMILES
- C=C1CCC(C(=C)C)CC=C(C)CCC1=O
- Molecular Weight1
- 218.33
- ω : Acentric Factor.
- 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).
- 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 |
|---|---|---|---|
| ω | 0.3595 | Relay (1.0) Calculated Property | |
| ΔfG° | 81.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -115.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.61 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.214 | Crippen Calculated Property | |
| McVol | 200.020 | ml/mol | McGowan Calculated Property |
| Pc | 2009.10 | kPa | Joback Calculated Property |
| Inp | [1665.00; 1665.00] |
|
|
| Inp | 1665.00 | NIST | |
| Inp | 1665.00 | NIST | |
| Tboil | 585.99 | K | Relay (1.0) Calculated Property |
| Tc | 774.96 | K | Relay (1.0) Calculated Property |
| Tfus | 294.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.636 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [539.64; 654.69] | J/mol×K | [646.91; 884.73] |
|
| Cp,gas | 539.64 | J/mol×K | 646.91 | Joback Calculated Property |
| Cp,gas | 562.65 | J/mol×K | 686.55 | Joback Calculated Property |
| Cp,gas | 584.17 | J/mol×K | 726.18 | Joback Calculated Property |
| Cp,gas | 604.16 | J/mol×K | 765.82 | Joback Calculated Property |
| Cp,gas | 622.60 | J/mol×K | 805.46 | Joback Calculated Property |
| Cp,gas | 639.45 | J/mol×K | 845.10 | Joback Calculated Property |
| Cp,gas | 654.69 | J/mol×K | 884.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to E-7-isopropenyl-4-methyl-10-methylene-4-cyclodecene-1-one.
Sources
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