- InChI
- InChI=1S/C14H22O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h4-5,7-8,10-11H,3,6,9,12-13H2,1-2H3/b5-4-,8-7-,11-10+
- InChI Key
- IVCSDEBPVQZWOF-OZENSHFISA-N
- Formula
- C14H22O
- SMILES
- CCC=CCC=CCC=CCCC(C)=O
- Molecular Weight1
- 206.32
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- I : 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 | 0.4319 | Relay (... Calculated Property | |
| ΔfG° | 178.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -260.80 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 34.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.24 | kJ/mol | Relay (... Calculated Property |
| IE | 8.57 | eV | Relay (... Calculated Property |
| log10WS | -3.65 | Relay (... Calculated Property | |
| logPoct/wat | 4.214 | Crippen Calculated Property | |
| McVol | 196.790 | ml/mol | McGowan Calculated Property |
| Pc | 1821.61 | kPa | Joback Calculated Property |
| I | [2033.00; 2033.00] |
|
|
| I | 2033.00 | NIST | |
| I | 2033.00 | NIST | |
| Tboil | 537.46 | K | Relay (... Calculated Property |
| Tc | 711.17 | K | Relay (... Calculated Property |
| Tfus | 273.01 | K | Relay (... Calculated Property |
| Vc | 0.669 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [480.20; 564.58] | J/mol×K | [586.07; 774.12] |
|
| Cp,gas | 480.20 | J/mol×K | 586.07 | Joback Calculated Property |
| Cp,gas | 496.22 | J/mol×K | 617.41 | Joback Calculated Property |
| Cp,gas | 511.39 | J/mol×K | 648.75 | Joback Calculated Property |
| Cp,gas | 525.76 | J/mol×K | 680.10 | Joback Calculated Property |
| Cp,gas | 539.38 | J/mol×K | 711.44 | Joback Calculated Property |
| Cp,gas | 552.30 | J/mol×K | 742.78 | Joback Calculated Property |
| Cp,gas | 564.58 | J/mol×K | 774.12 | Joback Calculated Property |
| η | [0.0001198; 0.0032895] | Pa×s | [282.23; 586.07] |
|
| η | 0.0032895 | Pa×s | 282.23 | Joback Calculated Property |
| η | 0.0012442 | Pa×s | 332.87 | Joback Calculated Property |
| η | 0.0006084 | Pa×s | 383.51 | Joback Calculated Property |
| η | 0.0003515 | Pa×s | 434.15 | Joback Calculated Property |
| η | 0.0002278 | Pa×s | 484.79 | Joback Calculated Property |
| η | 0.0001602 | Pa×s | 535.43 | Joback Calculated Property |
| η | 0.0001198 | Pa×s | 586.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (5E,8Z,11Z)-tetradecatrien-2-one.
Sources
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