- InChI
- InChI=1S/C28H22/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/h1-22H
- InChI Key
- KLCLIOISYBHYDZ-UHFFFAOYSA-N
- Formula
- C28H22
- SMILES
-
C(C=C(c1ccccc1)c1ccccc1)=C(c1c
cccc1)c1ccccc1 - Molecular Weight1
- 358.47
- CAS
- 1450-63-1
- Other Names
-
- 1,3-Butadiene, 1,1,4,4-tetraphenyl-
- 1,1,4,4-Tetraphenyl-1,3-butadiene
- 1,1,4,4-Tetraphenylbutadiene
- 1,1,4,4-tetraphenylbuta-1,3-diene
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 |
|---|---|---|---|
| ΔcH°solid | -14492.30 ± 3.00 | kJ/mol | NIST |
| ΔfG° | 777.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 539.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.10 | kJ/mol | Joback Calculated Property |
| log10WS | -8.20 | Crippen Calculated Property | |
| logPoct/wat | 7.250 | Crippen Calculated Property | |
| McVol | 301.740 | ml/mol | McGowan Calculated Property |
| Pc | 1641.76 | kPa | Joback Calculated Property |
| Tboil | 954.84 | K | Joback Calculated Property |
| Tc | 1237.13 | K | Joback Calculated Property |
| Tfus | 472.92 | K | Joback Calculated Property |
| Vc | 1.133 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [911.19; 1008.08] | J/mol×K | [954.84; 1237.13] | 
|
| Cp,gas | 911.19 | J/mol×K | 954.84 | Joback Calculated Property |
| Cp,gas | 928.75 | J/mol×K | 1001.89 | Joback Calculated Property |
| Cp,gas | 945.32 | J/mol×K | 1048.94 | Joback Calculated Property |
| Cp,gas | 961.20 | J/mol×K | 1095.98 | Joback Calculated Property |
| Cp,gas | 976.74 | J/mol×K | 1143.03 | Joback Calculated Property |
| Cp,gas | 992.26 | J/mol×K | 1190.08 | Joback Calculated Property |
| Cp,gas | 1008.08 | J/mol×K | 1237.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,1',1'',1'''-(1,3-butadiene-1,4-diylidene)tetrakis-.
Sources
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