- InChI
- InChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-3,5-6,14H,4,7-13H2,1H3/b3-2+,6-5-
- InChI Key
- XHXSPBYEQUMCKE-OHAITUNLSA-N
- Formula
- C14H24O
- SMILES
- CC=CCC=CCCCCCCCC=O
- Molecular Weight1
- 208.34
- 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.
- 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 | 0.5858 | Relay (1.0) Calculated Property | |
| ΔfG° | 127.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -282.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 34.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.59 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.438 | Crippen Calculated Property | |
| McVol | 201.090 | ml/mol | McGowan Calculated Property |
| Pc | 1759.49 | kPa | Joback Calculated Property |
| Inp | [1582.00; 1582.00] |
|
|
| Inp | 1582.00 | NIST | |
| Inp | 1582.00 | NIST | |
| I | [2053.00; 2053.00] |
|
|
| I | 2053.00 | NIST | |
| I | 2053.00 | NIST | |
| Tboil | 546.35 | K | Relay (1.0) Calculated Property |
| Tc | 733.98 | K | Relay (1.0) Calculated Property |
| Tfus | 278.83 | K | Relay (1.0) Calculated Property |
| Vc | 0.719 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [499.68; 585.49] | J/mol×K | [576.90; 754.16] |
|
| Cp,gas | 499.68 | J/mol×K | 576.90 | Joback Calculated Property |
| Cp,gas | 515.80 | J/mol×K | 606.44 | Joback Calculated Property |
| Cp,gas | 531.15 | J/mol×K | 635.99 | Joback Calculated Property |
| Cp,gas | 545.75 | J/mol×K | 665.53 | Joback Calculated Property |
| Cp,gas | 559.65 | J/mol×K | 695.07 | Joback Calculated Property |
| Cp,gas | 572.89 | J/mol×K | 724.62 | Joback Calculated Property |
| Cp,gas | 585.49 | J/mol×K | 754.16 | Joback Calculated Property |
| η | [0.0001538; 0.0040632] | Pa×s | [279.38; 576.90] |
|
| η | 0.0040632 | Pa×s | 279.38 | Joback Calculated Property |
| η | 0.0015604 | Pa×s | 328.97 | Joback Calculated Property |
| η | 0.0007700 | Pa×s | 378.55 | Joback Calculated Property |
| η | 0.0004475 | Pa×s | 428.14 | Joback Calculated Property |
| η | 0.0002911 | Pa×s | 477.73 | Joback Calculated Property |
| η | 0.0002053 | Pa×s | 527.31 | Joback Calculated Property |
| η | 0.0001538 | Pa×s | 576.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-9-(E)-12-Tetradecadienal.
Sources
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