- InChI
- InChI=1S/C14H10O/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H
- InChI Key
- ZWJPCOALBPMBIC-UHFFFAOYSA-N
- Formula
- C14H10O
- SMILES
- O=C=C(c1ccccc1)c1ccccc1
- Molecular Weight1
- 194.23
- Other Names
-
- Ethenone,diphenyl-
- 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 | 0.4376 | Relay (1.0) Calculated Property | |
| ΔfG° | 253.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 145.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.53 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [7.64; 7.85] | eV |
|
| IE | 7.85 | eV | NIST |
| IE | 7.64 ± 0.02 | eV | NIST |
| log10WS | -3.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.950 | Crippen Calculated Property | |
| McVol | 157.870 | ml/mol | McGowan Calculated Property |
| Pc | 3611.55 | kPa | Joback Calculated Property |
| Tboil | 569.56 | K | Relay (1.0) Calculated Property |
| Tc | 840.86 | K | Relay (1.0) Calculated Property |
| Tfus | 320.54 | K | Relay (1.0) Calculated Property |
| Vc | 0.561 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [185.84; 465.09] | 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 | -6.97100e+01 | |||
| Coefficient B | 1.15790e+00 | |||
| Coefficient C | -8.83700e-04 | |||
| Coefficient D | 2.60600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 185.84 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 240.87 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 287.97 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 327.98 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 361.71 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 389.99 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 413.64 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 433.50 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 450.37 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 465.09 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Ethenone, 2,2-diphenyl-.
Sources
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