- InChI
- InChI=1S/C8H14/c1-4-6-7-8(3)5-2/h4-6,8H,2,7H2,1,3H3/b6-4-
- InChI Key
- QIWJMWAOAINRPL-XQRVVYSFSA-N
- Formula
- C8H14
- SMILES
- C=CC(C)CC=CC
- Molecular Weight1
- 110.20
- CAS
- 50763-51-4
- Other Names
-
- 1,5-Heptadiene, 3-methyl-, (Z)-
- cis-3-Methyl-1,5-heptadiene
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.2537 | Relay (1.0) Calculated Property | |
| ΔfusH° | 11.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.03 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.775 | Crippen Calculated Property | |
| McVol | 114.980 | ml/mol | McGowan Calculated Property |
| Pc | 2817.33 | kPa | Joback Calculated Property |
| Tboil | 381.71 | K | Relay (1.0) Calculated Property |
| Tc | 541.35 | K | Relay (1.0) Calculated Property |
| Tfus | 162.93 | K | Relay (1.0) Calculated Property |
| Vc | 0.414 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [203.45; 271.28] | J/mol×K | [383.04; 562.76] | 
|
| Cp,gas | 203.45 | J/mol×K | 383.04 | Joback Calculated Property |
| Cp,gas | 216.19 | J/mol×K | 412.99 | Joback Calculated Property |
| Cp,gas | 228.32 | J/mol×K | 442.95 | Joback Calculated Property |
| Cp,gas | 239.87 | J/mol×K | 472.90 | Joback Calculated Property |
| Cp,gas | 250.87 | J/mol×K | 502.85 | Joback Calculated Property |
| Cp,gas | 261.33 | J/mol×K | 532.81 | Joback Calculated Property |
| Cp,gas | 271.28 | J/mol×K | 562.76 | Joback Calculated Property |
| η | [0.0001895; 0.0081563] | Pa×s | [158.08; 383.04] |
|
| η | 0.0081563 | Pa×s | 158.08 | Joback Calculated Property |
| η | 0.0023887 | Pa×s | 195.57 | Joback Calculated Property |
| η | 0.0010385 | Pa×s | 233.07 | Joback Calculated Property |
| η | 0.0005688 | Pa×s | 270.56 | Joback Calculated Property |
| η | 0.0003607 | Pa×s | 308.05 | Joback Calculated Property |
| η | 0.0002525 | Pa×s | 345.55 | Joback Calculated Property |
| η | 0.0001895 | Pa×s | 383.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (5Z)-3-Methyl-1,5-heptadiene.
Sources
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