2-[2-(trifluoromethyl)phenyl]acetonitrile
2-[2-(trifluoromethyl)phenyl]acetonitrile
| Molecular Formula | C9H6F3N |
|---|---|
| Molecular Weight | 185.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 23.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.04523 |
| Heavy Atoms | 13 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 3038-47-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC#N)C(F)(F)F |
| InChIKey | QXDCZSJGEUSERL-UHFFFAOYSA-N |
📖 Product Overview
2-[2-(trifluoromethyl)phenyl]acetonitrile (CAS: 3038-47-9) is a chemical compound with molecular formula C9H6F3N and molecular weight 185.15 g/mol. Its IUPAC systematic name is 2-[2-(trifluoromethyl)phenyl]acetonitrile.
QXDCZSJGEUSERL-UHFFFAOYSA-N.
SMILES: C1=CC=C(C(=C1)CC#N)C(F)(F)F.
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