- InChI
- InChI=1S/C14H22/c1-3-5-6-7-11-14-12-9-8-10-13(14)4-2/h8-10,12H,3-7,11H2,1-2H3
- InChI Key
- XMTLOBXRRJCFFJ-UHFFFAOYSA-N
- Formula
- C14H22
- SMILES
- CCCCCCc1ccccc1CC
- Molecular Weight1
- 190.32
- ω : Acentric Factor.
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5565 | Relay (... Calculated Property | |
| ΔfG° | 169.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -90.75 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 25.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.90 | kJ/mol | Relay (... Calculated Property |
| IE | 8.57 | eV | Relay (... Calculated Property |
| log10WS | -5.69 | Relay (... Calculated Property | |
| logPoct/wat | 4.372 | Crippen Calculated Property | |
| McVol | 184.360 | ml/mol | McGowan Calculated Property |
| Pc | 1982.35 | kPa | Joback Calculated Property |
| Inp | [1398.00; 1398.00] |
|
|
| Inp | 1398.00 | NIST | |
| Inp | 1398.00 | NIST | |
| Tboil | 527.34 | K | Relay (... Calculated Property |
| Tc | 720.94 | K | Relay (... Calculated Property |
| Tfus | 234.37 | K | Relay (... Calculated Property |
| Vc | 0.705 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [442.44; 536.64] | J/mol×K | [551.38; 746.43] |
|
| Cp,gas | 442.44 | J/mol×K | 551.38 | Joback Calculated Property |
| Cp,gas | 460.30 | J/mol×K | 583.89 | Joback Calculated Property |
| Cp,gas | 477.25 | J/mol×K | 616.40 | Joback Calculated Property |
| Cp,gas | 493.33 | J/mol×K | 648.91 | Joback Calculated Property |
| Cp,gas | 508.57 | J/mol×K | 681.42 | Joback Calculated Property |
| Cp,gas | 522.99 | J/mol×K | 713.92 | Joback Calculated Property |
| Cp,gas | 536.64 | J/mol×K | 746.43 | Joback Calculated Property |
| η | [0.0001755; 0.0026153] | Pa×s | [286.48; 551.38] |
|
| η | 0.0026153 | Pa×s | 286.48 | Joback Calculated Property |
| η | 0.0012344 | Pa×s | 330.63 | Joback Calculated Property |
| η | 0.0006953 | Pa×s | 374.78 | Joback Calculated Property |
| η | 0.0004420 | Pa×s | 418.93 | Joback Calculated Property |
| η | 0.0003064 | Pa×s | 463.08 | Joback Calculated Property |
| η | 0.0002263 | Pa×s | 507.23 | Joback Calculated Property |
| η | 0.0001755 | Pa×s | 551.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-ethyl-2-hexyl.
Sources
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