- InChI
- InChI=1S/C15H12O2/c16-14-15(11-17-14,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,11H2
- InChI Key
- KPURDRXLOMYQAS-UHFFFAOYSA-N
- Formula
- C15H12O2
- SMILES
- O=C1OCC1(c1ccccc1)c1ccccc1
- Molecular Weight1
- 224.25
- CAS
- 16230-71-0
- 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 |
|---|---|---|---|
| ΔfG° | 134.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -67.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.23 | kJ/mol | Joback Calculated Property |
| log10WS | -2.84 | Crippen Calculated Property | |
| logPoct/wat | 2.530 | Crippen Calculated Property | |
| McVol | 171.270 | ml/mol | McGowan Calculated Property |
| Pc | 3191.93 | kPa | Joback Calculated Property |
| Tboil | 701.98 | K | Joback Calculated Property |
| Tc | 982.17 | K | Joback Calculated Property |
| Tfus | 444.76 | K | Joback Calculated Property |
| Vc | 0.634 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [464.28; 557.98] | J/mol×K | [701.98; 982.17] | 
|
| Cp,gas | 464.28 | J/mol×K | 701.98 | Joback Calculated Property |
| Cp,gas | 481.79 | J/mol×K | 748.68 | Joback Calculated Property |
| Cp,gas | 498.17 | J/mol×K | 795.38 | Joback Calculated Property |
| Cp,gas | 513.70 | J/mol×K | 842.07 | Joback Calculated Property |
| Cp,gas | 528.65 | J/mol×K | 888.77 | Joback Calculated Property |
| Cp,gas | 543.32 | J/mol×K | 935.47 | Joback Calculated Property |
| Cp,gas | 557.98 | J/mol×K | 982.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Alpha,alpha-diphenyl-beta-propiolactone.
Sources
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