127952-87-8
Product Name:
Benzeneacetonitrile, α-amino-2-(trifluoromethyl)-, hydrochloride (1:1)
Formula:
C9H8ClF3N2
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COMPUTED DESCRIPTORS
| Molecular Weight | 236.62 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 236.0328104 g/mol |
| Monoisotopic Mass | 236.0328104 g/mol |
| Topological Polar Surface Area | 49.8 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 240 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |