- InChI
- InChI=1S/C13H18/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6-12H,2-5H2,1H3/b10-7+
- InChI Key
- PNLSTDKQAPNMDU-JXMROGBWSA-N
- Formula
- C13H18
- SMILES
- CCCCCC=Cc1ccccc1
- Molecular Weight1
- 174.28
- CAS
- 10201-58-8
- 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° | 251.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 42.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.77 | kJ/mol | Joback Calculated Property |
| log10WS | -4.39 | Crippen Calculated Property | |
| logPoct/wat | 4.280 | Crippen Calculated Property | |
| McVol | 165.970 | ml/mol | McGowan Calculated Property |
| Pc | 2304.74 | kPa | Joback Calculated Property |
| Inp | 1406.00 | NIST | |
| Tboil | 527.68 | K | Joback Calculated Property |
| Tc | 733.25 | K | Joback Calculated Property |
| Tfus | 257.61 | K | Joback Calculated Property |
| Vc | 0.635 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [375.09; 464.21] | J/mol×K | [527.68; 733.25] | 
|
| Cp,gas | 375.09 | J/mol×K | 527.68 | Joback Calculated Property |
| Cp,gas | 392.31 | J/mol×K | 561.94 | Joback Calculated Property |
| Cp,gas | 408.52 | J/mol×K | 596.20 | Joback Calculated Property |
| Cp,gas | 423.76 | J/mol×K | 630.46 | Joback Calculated Property |
| Cp,gas | 438.09 | J/mol×K | 664.72 | Joback Calculated Property |
| Cp,gas | 451.55 | J/mol×K | 698.98 | Joback Calculated Property |
| Cp,gas | 464.21 | J/mol×K | 733.25 | Joback Calculated Property |
| η | [0.0001646; 0.0035385] | Pa×s | [257.61; 527.68] |
|
| η | 0.0035385 | Pa×s | 257.61 | Joback Calculated Property |
| η | 0.0014508 | Pa×s | 302.62 | Joback Calculated Property |
| η | 0.0007493 | Pa×s | 347.63 | Joback Calculated Property |
| η | 0.0004503 | Pa×s | 392.64 | Joback Calculated Property |
| η | 0.0003005 | Pa×s | 437.66 | Joback Calculated Property |
| η | 0.0002163 | Pa×s | 482.67 | Joback Calculated Property |
| η | 0.0001646 | Pa×s | 527.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-heptenyl-, (E).
Sources
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