- InChI
- InChI=1S/C9H16/c1-5-7-8-9(3,4)6-2/h5-6H,1-2,7-8H2,3-4H3
- InChI Key
- YWOCVROBRVNVFV-UHFFFAOYSA-N
- Formula
- C9H16
- SMILES
- C=CCCC(C)(C)C=C
- Molecular Weight1
- 124.22
- CAS
- 68701-61-1
- 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).
- 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° | 203.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 13.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 32.99 | kJ/mol | Joback Calculated Property |
| log10WS | -3.06 | Crippen Calculated Property | |
| logPoct/wat | 3.165 | Crippen Calculated Property | |
| McVol | 129.070 | ml/mol | McGowan Calculated Property |
| Pc | 2553.34 | kPa | Joback Calculated Property |
| Tboil | 395.45 | K | Joback Calculated Property |
| Tc | 576.29 | K | Joback Calculated Property |
| Tfus | 190.09 | K | Joback Calculated Property |
| Vc | 0.490 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [243.47; 320.45] | J/mol×K | [395.45; 576.29] | 
|
| Cp,gas | 243.47 | J/mol×K | 395.45 | Joback Calculated Property |
| Cp,gas | 258.12 | J/mol×K | 425.59 | Joback Calculated Property |
| Cp,gas | 271.99 | J/mol×K | 455.73 | Joback Calculated Property |
| Cp,gas | 285.13 | J/mol×K | 485.87 | Joback Calculated Property |
| Cp,gas | 297.57 | J/mol×K | 516.01 | Joback Calculated Property |
| Cp,gas | 309.33 | J/mol×K | 546.15 | Joback Calculated Property |
| Cp,gas | 320.45 | J/mol×K | 576.29 | Joback Calculated Property |
| η | [0.0002576; 0.0082311] | Pa×s | [190.09; 395.45] |
|
| η | 0.0082311 | Pa×s | 190.09 | Joback Calculated Property |
| η | 0.0029744 | Pa×s | 224.32 | Joback Calculated Property |
| η | 0.0014073 | Pa×s | 258.54 | Joback Calculated Property |
| η | 0.0007931 | Pa×s | 292.77 | Joback Calculated Property |
| η | 0.0005040 | Pa×s | 327.00 | Joback Calculated Property |
| η | 0.0003490 | Pa×s | 361.22 | Joback Calculated Property |
| η | 0.0002576 | Pa×s | 395.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,6-Heptadiene, 3,3-dimethyl-.
Sources
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