- InChI
- InChI=1S/C13H20O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h6-7,9-13H,2-5,8H2,1H3/b7-6+,10-9+,12-11+
- InChI Key
- BIXIZZVISIZZDM-NRSJTBBXSA-N
- Formula
- C13H20O
- SMILES
- CCCCCC=CCC=CC=CC=O
- Molecular Weight1
- 192.30
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 199.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -45.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.13 | kJ/mol | Joback Calculated Property |
| log10WS | -4.11 | Crippen Calculated Property | |
| logPoct/wat | 3.824 | Crippen Calculated Property | |
| McVol | 182.700 | ml/mol | McGowan Calculated Property |
| Pc | 2000.12 | kPa | Joback Calculated Property |
| Inp | 1647.00 | NIST | |
| Tboil | 557.98 | K | Joback Calculated Property |
| Tc | 744.04 | K | Joback Calculated Property |
| Tfus | 263.03 | K | Joback Calculated Property |
| Vc | 0.721 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [430.82; 510.51] | J/mol×K | [557.98; 744.04] | 
|
| Cp,gas | 430.82 | J/mol×K | 557.98 | Joback Calculated Property |
| Cp,gas | 445.98 | J/mol×K | 588.99 | Joback Calculated Property |
| Cp,gas | 460.33 | J/mol×K | 620.00 | Joback Calculated Property |
| Cp,gas | 473.90 | J/mol×K | 651.01 | Joback Calculated Property |
| Cp,gas | 486.76 | J/mol×K | 682.02 | Joback Calculated Property |
| Cp,gas | 498.94 | J/mol×K | 713.03 | Joback Calculated Property |
| Cp,gas | 510.51 | J/mol×K | 744.04 | Joback Calculated Property |
| η | [0.0001428; 0.0039796] | Pa×s | [263.03; 557.98] |
|
| η | 0.0039796 | Pa×s | 263.03 | Joback Calculated Property |
| η | 0.0014768 | Pa×s | 312.19 | Joback Calculated Property |
| η | 0.0007177 | Pa×s | 361.35 | Joback Calculated Property |
| η | 0.0004146 | Pa×s | 410.50 | Joback Calculated Property |
| η | 0.0002693 | Pa×s | 459.66 | Joback Calculated Property |
| η | 0.0001902 | Pa×s | 508.82 | Joback Calculated Property |
| η | 0.0001428 | Pa×s | 557.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E,E,E)-2,4,7-tridecatrienal.
Sources
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