- InChI
- InChI=1S/C28H26/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27-28H,21-22H2
- InChI Key
- RYRPAXUFKAJVQC-UHFFFAOYSA-N
- Formula
- C28H26
- SMILES
-
c1ccc(C(CCC(c2ccccc2)c2ccccc2)
c2ccccc2)cc1 - Molecular Weight1
- 362.51
- CAS
- 1483-64-3
- Other Names
-
- 1,1,4,4-Tetraphenylbutane
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- 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 | 0.6162 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -14897.30 ± 4.00 | kJ/mol | NIST |
| ΔfG° | 629.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 342.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 135.72 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.38 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.24 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.431 | Crippen Calculated Property | |
| McVol | 310.340 | ml/mol | McGowan Calculated Property |
| Pc | 1518.75 | kPa | Joback Calculated Property |
| Tboil | 716.71 | K | Relay (1.0) Calculated Property |
| Tc | 1038.80 | K | Relay (1.0) Calculated Property |
| Tfus | 404.09 | K | Relay (1.0) Calculated Property |
| Vc | 1.117 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [369.81; 990.85] | 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 | -1.61548e+02 | |||
| Coefficient B | 2.36000e+00 | |||
| Coefficient C | -1.63060e-03 | |||
| Coefficient D | 4.23000e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 369.81 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 488.01 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 590.79 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 679.49 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 755.45 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 819.99 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 874.47 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 920.21 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 958.56 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 990.85 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0007746; 0.0000452] | Pa×s | [481.00; 848.57] |
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 | -1.37249e+01 | |||
| Coefficient B | 3.15624e+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. | 481.00 | |||
| Temperature range, max. | 848.57 | |||
| η | 0.0007746 | Pa×s | 481.00 | Calculated Property |
| η | 0.0004635 | Pa×s | 521.84 | Calculated Property |
| η | 0.0002988 | Pa×s | 562.68 | Calculated Property |
| η | 0.0002044 | Pa×s | 603.52 | Calculated Property |
| η | 0.0001468 | Pa×s | 644.36 | Calculated Property |
| η | 0.0001096 | Pa×s | 685.20 | Calculated Property |
| η | 0.0000846 | Pa×s | 726.05 | Calculated Property |
| η | 0.0000671 | Pa×s | 766.89 | Calculated Property |
| η | 0.0000545 | Pa×s | 807.73 | Calculated Property |
| η | 0.0000452 | Pa×s | 848.57 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,1',1'',1'''-(1,4-butanediylidene)tetrakis-.
Sources
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