Molecules
Compare molecules
Compare two to four records by formula, structure, functional groups, descriptors, source-backed properties, and spectroscopy availability.
| Feature | Pentanenitrile | Acetone |
|---|---|---|
| Formuladiffers | C5H9N | C3H6O |
| Molar massdiffers | 83.13 g·mol−1 | 58.08 g·mol−1 |
| Exact massdiffers | 83.073499291 | 58.041864811 |
| DBEdiffers | 2 | 1 |
| H-bond donors | 0 | 0 |
| H-bond acceptors | 1 | 1 |
| TPSAdiffers | 23.8 | 17.1 |
| logPdiffers | 1.1 (PubChem computed XLogP3-AA descriptor) | -0.1 (PubChem computed XLogP3-AA descriptor) |
| Melting point | Not available | Not available |
| Boiling pointdiffers | Not available | 56.05 deg C (1 atm) |
| Densitydiffers | Not available | 0.7845 g/mL (25 deg C) |
| Functional groupsdiffers | Nitrile | Ketone |
| Available spectra | simulated IR | simulated IR |