320424-54-2
Product Name:
3-(NITROMETHYL)-4-PHENYL-5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOLE
Formula:
C10H7F3N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 272.18 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 272.05210997 g/mol |
| Monoisotopic Mass | 272.05210997 g/mol |
| Topological Polar Surface Area | 76.5 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 328 |
| 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 |