- InChI
- InChI=1S/C16H14/c1-2-9-16(14-10-5-3-6-11-14)15-12-7-4-8-13-15/h2-13H,1H2
- InChI Key
- GUPMCMZMDAGSPF-UHFFFAOYSA-N
- Formula
- C16H14
- SMILES
- C=CC=C(c1ccccc1)c1ccccc1
- Molecular Weight1
- 206.28
- CAS
- 4165-81-5
- Other Names
-
- 1,1-diphenyl-1,3-butadiene
- ω : Acentric Factor.
- 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).
- 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 | 0.4268 | Relay (1.0) Calculated Property | |
| ΔfG° | 468.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 349.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.69 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.304 | Crippen Calculated Property | |
| McVol | 180.180 | ml/mol | McGowan Calculated Property |
| Pc | 2517.59 | kPa | Joback Calculated Property |
| Tboil | 582.35 | K | Relay (1.0) Calculated Property |
| Tc | 816.82 | K | Relay (1.0) Calculated Property |
| Tfus | 317.72 | K | Relay (1.0) Calculated Property |
| Vc | 0.638 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [429.75; 516.83] | J/mol×K | [619.56; 869.66] | 
|
| Cp,gas | 429.75 | J/mol×K | 619.56 | Joback Calculated Property |
| Cp,gas | 447.56 | J/mol×K | 661.24 | Joback Calculated Property |
| Cp,gas | 463.88 | J/mol×K | 702.93 | Joback Calculated Property |
| Cp,gas | 478.84 | J/mol×K | 744.61 | Joback Calculated Property |
| Cp,gas | 492.57 | J/mol×K | 786.30 | Joback Calculated Property |
| Cp,gas | 505.19 | J/mol×K | 827.98 | Joback Calculated Property |
| Cp,gas | 516.83 | J/mol×K | 869.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,1'-(1,3-butadienylidene)bis-.
Sources
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