Trichloroacetonitrile
CAS: 545-06-2
| 1 | TRICHLOROACETONITRILE |
| 2 | 2,2,2-trichloroacetonitrile |
| 3 | Cyanotrichloromethane |
| 4 | Trichloromethyl cyanide |
| 5 | Trichloroethanenitrile |
Trichloroacetonitrile is an aliphatic nitrile and an organochlorine compound.
| Molecular Formula | C2Cl3N |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 144.3800 |
| InChIKey | DRUIESSIVFYOMK-UHFFFAOYSA-N |
| InChI | InChI=1S/C2Cl3N/c3-2(4,5)1-6 |
| XLogP | 2.1000 |
| ExactMass | 142.9096 |
| MonoisotopicMass | 142.9096 |
| TPSA | 23.8000 |
| Complexity | 82.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 1 |
| RotatableBondCount | 0 |
| HeavyAtomCount | 6 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 9645 |
| PatentFamilyCount | 2393 |
| LiteratureCount | 558 |