- InChI
- InChI=1S/C8H16/c1-7(2)5-6-8(3)4/h5-8H,1-4H3/b6-5-
- InChI Key
- KNCMKWVOMRUHKZ-WAYWQWQTSA-N
- Formula
- C8H16
- SMILES
- CC(C)C=CC(C)C
- Molecular Weight1
- 112.21
- CAS
- 10557-44-5
- Other Names
-
- 3-Hexene, 2,5-dimethyl-, (Z)-
- (Z)-2,5-Dimethyl-3-hexene
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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.
- 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 |
|---|---|---|---|
| ΔcH°liquid | [-5283.70; -5273.80] | kJ/mol |
|
| ΔcH°liquid | -5283.70 ± 1.80 | kJ/mol | NIST |
| ΔcH°liquid | -5273.80 ± 1.20 | kJ/mol | NIST |
| ΔfG° | 91.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -111.30 | kJ/mol | NIST |
| ΔfH°liquid | -151.10 ± 1.80 | kJ/mol | NIST |
| ΔfusH° | 9.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.20 | kJ/mol | NIST |
| IE | 8.85 ± 0.01 | eV | NIST |
| log10WS | -2.54 | Crippen Calculated Property | |
| logPoct/wat | 2.855 | Crippen Calculated Property | |
| McVol | 119.280 | ml/mol | McGowan Calculated Property |
| Pc | 2718.33 | kPa | Joback Calculated Property |
| Inp | [683.90; 701.00] |
|
|
| Inp | 696.60 | NIST | |
| Inp | 683.90 | NIST | |
| Inp | 701.00 | NIST | |
| Tboil | 371.80 ± 0.70 | K | NIST |
| Tc | 565.78 | K | Joback Calculated Property |
| Tfus | 144.84 | K | Joback Calculated Property |
| Vc | 0.452 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [217.83; 291.30] | J/mol×K | [385.72; 565.78] |
|
| Cp,gas | 217.83 | J/mol×K | 385.72 | Joback Calculated Property |
| Cp,gas | 231.54 | J/mol×K | 415.73 | Joback Calculated Property |
| Cp,gas | 244.62 | J/mol×K | 445.74 | Joback Calculated Property |
| Cp,gas | 257.12 | J/mol×K | 475.75 | Joback Calculated Property |
| Cp,gas | 269.06 | J/mol×K | 505.76 | Joback Calculated Property |
| Cp,gas | 280.44 | J/mol×K | 535.77 | Joback Calculated Property |
| Cp,gas | 291.30 | J/mol×K | 565.78 | Joback Calculated Property |
| η | [0.0001887; 0.0231611] | Pa×s | [144.84; 385.72] |
|
| η | 0.0231611 | Pa×s | 144.84 | Joback Calculated Property |
| η | 0.0043531 | Pa×s | 184.99 | Joback Calculated Property |
| η | 0.0014851 | Pa×s | 225.13 | Joback Calculated Property |
| η | 0.0007016 | Pa×s | 265.28 | Joback Calculated Property |
| η | 0.0004036 | Pa×s | 305.43 | Joback Calculated Property |
| η | 0.0002641 | Pa×s | 345.57 | Joback Calculated Property |
| η | 0.0001887 | Pa×s | 385.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-2,5-Dimethylhex-3-ene.
Sources
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