- InChI
- InChI=1S/C24H18/c1-3-8-19(9-4-1)21-14-16-22(17-15-21)24-13-7-12-23(18-24)20-10-5-2-6-11-20/h1-18H
- InChI Key
- JQGLMRCAOAALPG-UHFFFAOYSA-N
- Formula
- C24H18
- SMILES
-
c1ccc(-c2ccc(-c3cccc(-c4ccccc4
)c3)cc2)cc1 - Molecular Weight1
- 306.40
- CAS
- 29036-02-0
- 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.
- 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 | 0.5638 | Relay (1.0) Calculated Property | |
| ΔfG° | 581.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 408.57 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 133.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.86 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.688 | Crippen Calculated Property | |
| McVol | 253.980 | ml/mol | McGowan Calculated Property |
| Pc | 2014.51 | kPa | Joback Calculated Property |
| Inp | [476.30; 476.30] |
|
|
| Inp | 476.30 | NIST | |
| Inp | 476.30 | NIST | |
| Tboil | 745.88 | K | Relay (1.0) Calculated Property |
| Tc | 1022.15 | K | Relay (1.0) Calculated Property |
| Tfus | 415.14 | K | Relay (1.0) Calculated Property |
| Vc | 0.945 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [290.69; 777.33] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.25950e+02 | |||
| Coefficient B | 1.84920e+00 | |||
| Coefficient C | -1.27252e-03 | |||
| Coefficient D | 3.26600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 290.69 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 383.45 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 464.13 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 533.76 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 593.37 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 644.00 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 686.68 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 722.44 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 752.31 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 777.33 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0006475; 0.0000827] | Pa×s | [490.96; 802.62] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.26411e+01 | |||
| Coefficient B | 2.60144e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 490.96 | |||
| Temperature range, max. | 802.62 | |||
| η | 0.0006475 | Pa×s | 490.96 | Calculated Property |
| η | 0.0004567 | Pa×s | 525.59 | Calculated Property |
| η | 0.0003363 | Pa×s | 560.22 | Calculated Property |
| η | 0.0002567 | Pa×s | 594.85 | Calculated Property |
| η | 0.0002018 | Pa×s | 629.47 | Calculated Property |
| η | 0.0001627 | Pa×s | 664.10 | Calculated Property |
| η | 0.0001340 | Pa×s | 698.73 | Calculated Property |
| η | 0.0001124 | Pa×s | 733.36 | Calculated Property |
| η | 0.0000958 | Pa×s | 767.99 | Calculated Property |
| η | 0.0000827 | Pa×s | 802.62 | Calculated Property |
Similar Compounds
Find more compounds similar to Quaterphenyl-.
Sources
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