- InChI
- InChI=1S/C20H14O2/c21-19(15-8-3-1-4-9-15)17-12-7-13-18(14-17)20(22)16-10-5-2-6-11-16/h1-14H
- InChI Key
- MJQHDSIEDGPFAM-UHFFFAOYSA-N
- Formula
- C20H14O2
- SMILES
-
O=C(c1ccccc1)c1cccc(C(=O)c2ccc
cc2)c1 - Molecular Weight1
- 286.32
- CAS
- 3770-82-9
- Other Names
-
- m-Dibenzoylbenzene
- Methanone, 1,3-phenylenebis[phenyl-
- ω : Acentric Factor.
- 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 | 0.6818 | Relay (1.0) Calculated Property | |
| ΔfG° | 187.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 6.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 123.73 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.46 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.149 | Crippen Calculated Property | |
| McVol | 224.520 | ml/mol | McGowan Calculated Property |
| Pc | 2417.12 | kPa | Joback Calculated Property |
| Tboil | 678.41 | K | Relay (1.0) Calculated Property |
| Tc | 997.66 | K | Relay (1.0) Calculated Property |
| Tfus | 404.15 | K | Relay (1.0) Calculated Property |
| Vc | 0.823 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [629.67; 693.46] | J/mol×K | [849.96; 1115.70] | 
|
| Cp,gas | 629.67 | J/mol×K | 849.96 | Joback Calculated Property |
| Cp,gas | 643.33 | J/mol×K | 894.25 | Joback Calculated Property |
| Cp,gas | 655.60 | J/mol×K | 938.54 | Joback Calculated Property |
| Cp,gas | 666.61 | J/mol×K | 982.83 | Joback Calculated Property |
| Cp,gas | 676.50 | J/mol×K | 1027.12 | Joback Calculated Property |
| Cp,gas | 685.40 | J/mol×K | 1071.41 | Joback Calculated Property |
| Cp,gas | 693.46 | J/mol×K | 1115.70 | Joback Calculated Property |
| η | [0.0001003; 0.0008865] | Pa×s | [506.80; 849.96] |
|
| η | 0.0008865 | Pa×s | 506.80 | Joback Calculated Property |
| η | 0.0005129 | Pa×s | 563.99 | Joback Calculated Property |
| η | 0.0003282 | Pa×s | 621.19 | Joback Calculated Property |
| η | 0.0002264 | Pa×s | 678.38 | Joback Calculated Property |
| η | 0.0001655 | Pa×s | 735.57 | Joback Calculated Property |
| η | 0.0001265 | Pa×s | 792.77 | Joback Calculated Property |
| η | 0.0001003 | Pa×s | 849.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dibenzoylbenzene.
Sources
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