- InChI
- InChI=1S/C17H16/c1-15(17-13-6-3-7-14-17)9-8-12-16-10-4-2-5-11-16/h2-11,13-14H,1,12H2/b9-8+
- InChI Key
- LOUCPTJGQXEIQI-CMDGGOBGSA-N
- Formula
- C17H16
- SMILES
- C=C(C=CCc1ccccc1)c1ccccc1
- Molecular Weight1
- 220.31
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 476.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 311.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.36 | kJ/mol | Joback Calculated Property |
| log10WS | -5.02 | Crippen Calculated Property | |
| logPoct/wat | 4.499 | Crippen Calculated Property | |
| McVol | 194.270 | ml/mol | McGowan Calculated Property |
| Pc | 2291.52 | kPa | Joback Calculated Property |
| Inp | [1942.90; 1942.90] |
|
|
| Inp | 1942.90 | NIST | |
| Inp | 1942.90 | NIST | |
| Tboil | 642.44 | K | Joback Calculated Property |
| Tc | 887.02 | K | Joback Calculated Property |
| Tfus | 313.39 | K | Joback Calculated Property |
| Vc | 0.734 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [480.54; 570.28] | J/mol×K | [642.44; 887.02] |
|
| Cp,gas | 480.54 | J/mol×K | 642.44 | Joback Calculated Property |
| Cp,gas | 498.74 | J/mol×K | 683.20 | Joback Calculated Property |
| Cp,gas | 515.47 | J/mol×K | 723.97 | Joback Calculated Property |
| Cp,gas | 530.86 | J/mol×K | 764.73 | Joback Calculated Property |
| Cp,gas | 545.04 | J/mol×K | 805.49 | Joback Calculated Property |
| Cp,gas | 558.14 | J/mol×K | 846.26 | Joback Calculated Property |
| Cp,gas | 570.28 | J/mol×K | 887.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,5-diphenyl-1,3-pentadiene.
Sources
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