680214-05-5
Product Name:
2-CHLORO-6-(3-NITROANILINO)-4-(TRIFLUOROMETHYL)NICOTINONITRILE, TECH
Formula:
C13H6ClF3N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 342.66 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 342.0131376 g/mol |
| Monoisotopic Mass | 342.0131376 g/mol |
| Topological Polar Surface Area | 94.5 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 490 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |