- InChI
- InChI=1S/C9H14O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-9H,2,5-6H2,1H3/b4-3+,8-7+
- InChI Key
- HZYHMHHBBBSGHB-DYWGDJMRSA-N
- Formula
- C9H14O
- SMILES
- CCC=CCCC=CC=O
- Molecular Weight1
- 138.21
- CAS
- 17587-33-6
- Other Names
-
- trans-2-trans-6-Nonadienal
- 2-trans-6-trans-Nonadienal
- 2,6-trans,trans-Nonadienal
- (2E,6E)-2,6-Nonadienal
- (E,E)-2,6-Nonadienal
- (2E,6E)-nona-2,6-dien-1-al
- 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 | 0.3833 | Relay (... Calculated Property | |
| ΔfG° | 85.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -152.46 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 21.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.27 | kJ/mol | Relay (... Calculated Property |
| IE | 9.40 | eV | Relay (... Calculated Property |
| log10WS | -2.32 | Relay (... Calculated Property | |
| logPoct/wat | 2.488 | Crippen Calculated Property | |
| McVol | 130.640 | ml/mol | McGowan Calculated Property |
| Pc | 2758.46 | kPa | Joback Calculated Property |
| Inp | [1146.00; 1162.00] |
|
|
| Inp | 1153.10 | NIST | |
| Inp | 1152.00 | NIST | |
| Inp | 1146.00 | NIST | |
| Inp | 1146.00 | NIST | |
| Inp | 1162.00 | NIST | |
| Inp | 1153.10 | NIST | |
| Inp | 1152.00 | NIST | |
| I | [1715.00; 1715.00] |
|
|
| I | 1715.00 | NIST | |
| I | 1715.00 | NIST | |
| Tboil | 460.57 | K | Relay (... Calculated Property |
| Tc | 662.14 | K | Relay (... Calculated Property |
| Tfus | 206.40 | K | Relay (... Calculated Property |
| Vc | 0.468 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [266.24; 332.06] | J/mol×K | [462.30; 648.39] |
|
| Cp,gas | 266.24 | J/mol×K | 462.30 | Joback Calculated Property |
| Cp,gas | 278.77 | J/mol×K | 493.32 | Joback Calculated Property |
| Cp,gas | 290.63 | J/mol×K | 524.33 | Joback Calculated Property |
| Cp,gas | 301.85 | J/mol×K | 555.35 | Joback Calculated Property |
| Cp,gas | 312.48 | J/mol×K | 586.36 | Joback Calculated Property |
| Cp,gas | 322.54 | J/mol×K | 617.38 | Joback Calculated Property |
| Cp,gas | 332.06 | J/mol×K | 648.39 | Joback Calculated Property |
| η | [0.0002135; 0.0043918] | Pa×s | [223.03; 462.30] |
|
| η | 0.0043918 | Pa×s | 223.03 | Joback Calculated Property |
| η | 0.0018105 | Pa×s | 262.91 | Joback Calculated Property |
| η | 0.0009426 | Pa×s | 302.79 | Joback Calculated Property |
| η | 0.0005712 | Pa×s | 342.66 | Joback Calculated Property |
| η | 0.0003843 | Pa×s | 382.54 | Joback Calculated Property |
| η | 0.0002786 | Pa×s | 422.42 | Joback Calculated Property |
| η | 0.0002135 | Pa×s | 462.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Nonadienal, (E,E)-.
Sources
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