- InChI
- InChI=1S/C18H30/c1-7-13(4)16-10-17(14(5)8-2)12-18(11-16)15(6)9-3/h10-15H,7-9H2,1-6H3
- InChI Key
- LNCLJYZMKXSECB-UHFFFAOYSA-N
- Formula
- C18H30
- SMILES
- CCC(C)c1cc(C(C)CC)cc(C(C)CC)c1
- Molecular Weight1
- 246.44
- Other Names
-
- Benzene, 1,3,5-tri-sec-butyl-
- 1,3,5-Tri-sec-butylbenzene
- 1,3,5-Tri-s-butylbenzene
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5715 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -257.82 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.90 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 6.227 | Crippen Calculated Property | |
| McVol | 240.720 | ml/mol | McGowan Calculated Property |
| Pc | 1455.68 | kPa | Joback Calculated Property |
| Tboil | 557.19 | K | Relay (1.0) Calculated Property |
| Tc | 766.21 | K | Relay (1.0) Calculated Property |
| Tfus | 276.92 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, 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 | [655.44; 763.00] | J/mol×K | [646.76; 843.89] | 
|
| Cp,gas | 655.44 | J/mol×K | 646.76 | Joback Calculated Property |
| Cp,gas | 675.94 | J/mol×K | 679.61 | Joback Calculated Property |
| Cp,gas | 695.36 | J/mol×K | 712.47 | Joback Calculated Property |
| Cp,gas | 713.74 | J/mol×K | 745.32 | Joback Calculated Property |
| Cp,gas | 731.12 | J/mol×K | 778.18 | Joback Calculated Property |
| Cp,gas | 747.52 | J/mol×K | 811.03 | Joback Calculated Property |
| Cp,gas | 763.00 | J/mol×K | 843.89 | Joback Calculated Property |
| η | [0.0000965; 0.0038426] | Pa×s | [299.08; 646.76] |
|
| η | 0.0038426 | Pa×s | 299.08 | Joback Calculated Property |
| η | 0.0012634 | Pa×s | 357.03 | Joback Calculated Property |
| η | 0.0005668 | Pa×s | 414.97 | Joback Calculated Property |
| η | 0.0003094 | Pa×s | 472.92 | Joback Calculated Property |
| η | 0.0001928 | Pa×s | 530.87 | Joback Calculated Property |
| η | 0.0001318 | Pa×s | 588.81 | Joback Calculated Property |
| η | 0.0000965 | Pa×s | 646.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,3,5-tris(1-methylpropyl)-.
Sources
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