- InChI
- InChI=1S/C24H26/c1-23(2,3)19-13-9-15-8-12-18-20(24(4,5)6)14-10-16-7-11-17(19)21(15)22(16)18/h7-14H,1-6H3
- InChI Key
- OJKOMTHSAKFOHL-UHFFFAOYSA-N
- Formula
- C24H26
- SMILES
-
CC(C)(C)c1ccc2ccc3c(C(C)(C)C)c
cc4ccc1c2c43 - Molecular Weight1
- 314.46
- CAS
- 55044-29-6
- Other Names
-
- 1,6-Di-tert-butylpyrene
- 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).
- 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° | 544.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 162.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.63 | kJ/mol | Joback Calculated Property |
| log10WS | -8.93 | Crippen Calculated Property | |
| logPoct/wat | 7.179 | Crippen Calculated Property | |
| McVol | 271.180 | ml/mol | McGowan Calculated Property |
| Pc | 1521.12 | kPa | Joback Calculated Property |
| Tboil | 837.90 | K | Joback Calculated Property |
| Tc | 1081.18 | K | Joback Calculated Property |
| Tfus | 545.96 | K | Joback Calculated Property |
| Vc | 1.046 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [817.66; 918.41] | J/mol×K | [837.90; 1081.18] | 
|
| Cp,gas | 817.66 | J/mol×K | 837.90 | Joback Calculated Property |
| Cp,gas | 835.32 | J/mol×K | 878.45 | Joback Calculated Property |
| Cp,gas | 852.29 | J/mol×K | 918.99 | Joback Calculated Property |
| Cp,gas | 868.82 | J/mol×K | 959.54 | Joback Calculated Property |
| Cp,gas | 885.19 | J/mol×K | 1000.09 | Joback Calculated Property |
| Cp,gas | 901.63 | J/mol×K | 1040.63 | Joback Calculated Property |
| Cp,gas | 918.41 | J/mol×K | 1081.18 | Joback Calculated Property |
| η | [0.0005561; 0.0016000] | Pa×s | [545.96; 837.90] |
|
| η | 0.0016000 | Pa×s | 545.96 | Joback Calculated Property |
| η | 0.0012483 | Pa×s | 594.62 | Joback Calculated Property |
| η | 0.0010112 | Pa×s | 643.27 | Joback Calculated Property |
| η | 0.0008437 | Pa×s | 691.93 | Joback Calculated Property |
| η | 0.0007210 | Pa×s | 740.59 | Joback Calculated Property |
| η | 0.0006281 | Pa×s | 789.24 | Joback Calculated Property |
| η | 0.0005561 | Pa×s | 837.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pyrene, 1,6-bis(1,1-dimethylethyl)-.
Sources
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