- InChI
- InChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h8-14H,2-7H2,1H3/b9-8+,11-10+,13-12+
- InChI Key
- MHJQZJXVYHMAAZ-GTEMLCSVSA-N
- Formula
- C14H22O
- SMILES
- CCCCCCCC=CC=CC=CC=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).
- 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 | 0.5521 | Relay (1.0) Calculated Property | |
| ΔfG° | 208.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -178.36 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.214 | Crippen Calculated Property | |
| McVol | 196.790 | ml/mol | McGowan Calculated Property |
| Pc | 1838.84 | kPa | Joback Calculated Property |
| Inp | [1806.00; 1806.00] |
|
|
| Inp | 1806.00 | NIST | |
| Inp | 1806.00 | NIST | |
| Tboil | 534.72 | K | Relay (1.0) Calculated Property |
| Tc | 731.63 | K | Relay (1.0) Calculated Property |
| Tfus | 343.84 | K | Relay (1.0) Calculated Property |
| Vc | 0.695 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [480.34; 563.25] | J/mol×K | [580.86; 764.94] |
|
| Cp,gas | 480.34 | J/mol×K | 580.86 | Joback Calculated Property |
| Cp,gas | 496.06 | J/mol×K | 611.54 | Joback Calculated Property |
| Cp,gas | 510.95 | J/mol×K | 642.22 | Joback Calculated Property |
| Cp,gas | 525.06 | J/mol×K | 672.90 | Joback Calculated Property |
| Cp,gas | 538.45 | J/mol×K | 703.58 | Joback Calculated Property |
| Cp,gas | 551.16 | J/mol×K | 734.26 | Joback Calculated Property |
| Cp,gas | 563.25 | J/mol×K | 764.94 | Joback Calculated Property |
| η | [0.0001313; 0.0038084] | Pa×s | [274.30; 580.86] |
|
| η | 0.0038084 | Pa×s | 274.30 | Joback Calculated Property |
| η | 0.0013985 | Pa×s | 325.39 | Joback Calculated Property |
| η | 0.0006740 | Pa×s | 376.49 | Joback Calculated Property |
| η | 0.0003868 | Pa×s | 427.58 | Joback Calculated Property |
| η | 0.0002499 | Pa×s | 478.67 | Joback Calculated Property |
| η | 0.0001756 | Pa×s | 529.77 | Joback Calculated Property |
| η | 0.0001313 | Pa×s | 580.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E,E,E)-2,4,6-tetradecatrienal.
Sources
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