- InChI
- InChI=1S/C14H22/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h5-8,11-12H,9-10H2,1-4H3
- InChI Key
- YQFHOVFZIZQLNU-UHFFFAOYSA-N
- Formula
- C14H22
- SMILES
- CC(C)Cc1ccc(CC(C)C)cc1
- 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.
- I : 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 | 0.5194 | Relay (1.0) Calculated Property | |
| ΔfG° | 164.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -136.00 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.73 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.51 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.084 | Crippen Calculated Property | |
| McVol | 184.360 | ml/mol | McGowan Calculated Property |
| Pc | 2010.90 | kPa | Joback Calculated Property |
| Inp | [1308.00; 1308.00] |
|
|
| Inp | 1308.00 | NIST | |
| Inp | 1308.00 | NIST | |
| I | [1495.00; 1500.80] |
|
|
| I | 1500.80 | NIST | |
| I | 1495.00 | NIST | |
| I | 1500.80 | NIST | |
| I | 1495.00 | NIST | |
| I | 1495.00 | NIST | |
| Tboil | 519.24 | K | Relay (1.0) Calculated Property |
| Tc | 707.72 | K | Relay (1.0) Calculated Property |
| Tfus | 273.39 | K | Relay (1.0) Calculated Property |
| Vc | 0.698 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [442.99; 541.12] | J/mol×K | [550.50; 753.79] |
|
| Cp,gas | 442.99 | J/mol×K | 550.50 | Joback Calculated Property |
| Cp,gas | 461.73 | J/mol×K | 584.38 | Joback Calculated Property |
| Cp,gas | 479.47 | J/mol×K | 618.26 | Joback Calculated Property |
| Cp,gas | 496.24 | J/mol×K | 652.14 | Joback Calculated Property |
| Cp,gas | 512.08 | J/mol×K | 686.03 | Joback Calculated Property |
| Cp,gas | 527.03 | J/mol×K | 719.91 | Joback Calculated Property |
| Cp,gas | 541.12 | J/mol×K | 753.79 | Joback Calculated Property |
| η | [0.0001548; 0.0051862] | Pa×s | [256.48; 550.50] |
|
| η | 0.0051862 | Pa×s | 256.48 | Joback Calculated Property |
| η | 0.0018062 | Pa×s | 305.48 | Joback Calculated Property |
| η | 0.0008420 | Pa×s | 354.49 | Joback Calculated Property |
| η | 0.0004725 | Pa×s | 403.49 | Joback Calculated Property |
| η | 0.0003005 | Pa×s | 452.49 | Joback Calculated Property |
| η | 0.0002088 | Pa×s | 501.50 | Joback Calculated Property |
| η | 0.0001548 | Pa×s | 550.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,4-bis-(2-methylpropyl).
Sources
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