338402-61-2
Product Name:
N-[2-(3-Methyl-4-nitro-5-isoxazolyl)vinyl]-4-(trifluoromethoxy)aniline
Formula:
C13H10F3N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 329.23 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 329.06234029 g/mol |
| Monoisotopic Mass | 329.06234029 g/mol |
| Topological Polar Surface Area | 93.1 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 433 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |