- InChI
- InChI=1S/C26H36/c1-2-3-4-5-6-7-8-9-12-22-19-23-15-10-13-20-17-18-21-14-11-16-24(22)26(21)25(20)23/h17-19H,2-16H2,1H3
- InChI Key
- RJQGNYIKTOWQRO-UHFFFAOYSA-N
- Formula
- C26H36
- SMILES
-
CCCCCCCCCCc1cc2c3c(ccc4c3c1CCC
4)CCC2 - Molecular Weight1
- 348.56
- CAS
- 56247-94-0
- Other Names
-
- 4-n-Decyl-(1,2,3,6,7,8-hexahydropyrene)
- 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° | 475.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -23.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.14 | kJ/mol | Joback Calculated Property |
| log10WS | -9.59 | Crippen Calculated Property | |
| logPoct/wat | 7.500 | Crippen Calculated Property | |
| McVol | 312.260 | ml/mol | McGowan Calculated Property |
| Pc | 1199.79 | kPa | Joback Calculated Property |
| Tboil | 887.66 | K | Joback Calculated Property |
| Tc | 1104.19 | K | Joback Calculated Property |
| Tfus | 345.65 ± 0.50 | K | NIST |
| Vc | 1.222 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1022.68; 1133.77] | J/mol×K | [887.66; 1104.19] | 
|
| Cp,gas | 1022.68 | J/mol×K | 887.66 | Joback Calculated Property |
| Cp,gas | 1042.59 | J/mol×K | 923.75 | Joback Calculated Property |
| Cp,gas | 1061.73 | J/mol×K | 959.84 | Joback Calculated Property |
| Cp,gas | 1080.28 | J/mol×K | 995.93 | Joback Calculated Property |
| Cp,gas | 1098.36 | J/mol×K | 1032.01 | Joback Calculated Property |
| Cp,gas | 1116.14 | J/mol×K | 1068.10 | Joback Calculated Property |
| Cp,gas | 1133.77 | J/mol×K | 1104.19 | Joback Calculated Property |
| η | [0.0005809; 0.0018971] | Pa×s | [548.86; 887.66] |
|
| η | 0.0018971 | Pa×s | 548.86 | Joback Calculated Property |
| η | 0.0014206 | Pa×s | 605.33 | Joback Calculated Property |
| η | 0.0011176 | Pa×s | 661.79 | Joback Calculated Property |
| η | 0.0009130 | Pa×s | 718.26 | Joback Calculated Property |
| η | 0.0007682 | Pa×s | 774.73 | Joback Calculated Property |
| η | 0.0006617 | Pa×s | 831.19 | Joback Calculated Property |
| η | 0.0005809 | Pa×s | 887.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pyrene, 4-decyl-1,2,3,6,7,8-hexahydro-.
Sources
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