- InChI
- InChI=1S/C13H24/c1-10(2)7-12(5)9-13(6)8-11(3)4/h12-13H,1,3,7-9H2,2,4-6H3
- InChI Key
- ZWOKFAVFJDZGAW-UHFFFAOYSA-N
- Formula
- C13H24
- SMILES
- C=C(C)CC(C)CC(C)CC(=C)C
- Molecular Weight1
- 180.33
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | 212.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -90.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.58 | kJ/mol | Joback Calculated Property |
| log10WS | -4.49 | Crippen Calculated Property | |
| logPoct/wat | 4.581 | Crippen Calculated Property | |
| McVol | 185.430 | ml/mol | McGowan Calculated Property |
| Pc | 1801.56 | kPa | Joback Calculated Property |
| Inp | [1157.00; 1157.00] |
|
|
| Inp | 1157.00 | NIST | |
| Inp | 1157.00 | NIST | |
| Tboil | 489.08 | K | Joback Calculated Property |
| Tc | 667.82 | K | Joback Calculated Property |
| Tfus | 174.83 | K | Joback Calculated Property |
| Vc | 0.716 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [418.47; 514.49] | J/mol×K | [489.08; 667.82] |
|
| Cp,gas | 418.47 | J/mol×K | 489.08 | Joback Calculated Property |
| Cp,gas | 436.41 | J/mol×K | 518.87 | Joback Calculated Property |
| Cp,gas | 453.54 | J/mol×K | 548.66 | Joback Calculated Property |
| Cp,gas | 469.88 | J/mol×K | 578.45 | Joback Calculated Property |
| Cp,gas | 485.47 | J/mol×K | 608.24 | Joback Calculated Property |
| Cp,gas | 500.33 | J/mol×K | 638.03 | Joback Calculated Property |
| Cp,gas | 514.49 | J/mol×K | 667.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,8-Nonadiene, 2,4,6,8-tetramethyl, # 2.
Sources
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