- InChI
- InChI=1S/C26H28/c1-2-3-4-5-6-7-13-21-19-26-22-14-9-8-12-20(22)17-18-25(26)24-16-11-10-15-23(21)24/h8-12,14-19H,2-7,13H2,1H3
- InChI Key
- KTSUECCHGKCKHX-UHFFFAOYSA-N
- Formula
- C26H28
- SMILES
-
CCCCCCCCc1cc2c3ccccc3ccc2c2ccc
cc12 - Molecular Weight1
- 340.50
- CAS
- 56248-66-9
- Other Names
-
- 6-n-Octylchrysene
- 6-octylchrysene
- 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° | 571.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 195.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.65 | kJ/mol | Joback Calculated Property |
| log10WS | -10.20 | Crippen Calculated Property | |
| logPoct/wat | 8.049 | Crippen Calculated Property | |
| McVol | 295.060 | ml/mol | McGowan Calculated Property |
| Pc | 1378.88 | kPa | Joback Calculated Property |
| Tboil | 892.84 | K | Joback Calculated Property |
| Tc | 1122.29 | K | Joback Calculated Property |
| Tfus | 544.86 | K | Joback Calculated Property |
| Vc | 1.149 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [913.26; 1010.72] | J/mol×K | [892.84; 1122.29] | 
|
| Cp,gas | 913.26 | J/mol×K | 892.84 | Joback Calculated Property |
| Cp,gas | 930.82 | J/mol×K | 931.08 | Joback Calculated Property |
| Cp,gas | 947.64 | J/mol×K | 969.32 | Joback Calculated Property |
| Cp,gas | 963.87 | J/mol×K | 1007.57 | Joback Calculated Property |
| Cp,gas | 979.69 | J/mol×K | 1045.81 | Joback Calculated Property |
| Cp,gas | 995.25 | J/mol×K | 1084.05 | Joback Calculated Property |
| Cp,gas | 1010.72 | J/mol×K | 1122.29 | Joback Calculated Property |
| η | [0.0003834; 0.0013363] | Pa×s | [544.86; 892.84] |
|
| η | 0.0013363 | Pa×s | 544.86 | Joback Calculated Property |
| η | 0.0009818 | Pa×s | 602.86 | Joback Calculated Property |
| η | 0.0007615 | Pa×s | 660.85 | Joback Calculated Property |
| η | 0.0006154 | Pa×s | 718.85 | Joback Calculated Property |
| η | 0.0005133 | Pa×s | 776.85 | Joback Calculated Property |
| η | 0.0004391 | Pa×s | 834.84 | Joback Calculated Property |
| η | 0.0003834 | Pa×s | 892.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Chrysene, 6-octyl-.
Sources
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