351063-95-1
Product Name:
Isoxazole, 5-(chloromethyl)-4,5-dihydro-3-(trifluoromethyl)- (9CI)
Formula:
C5H5ClF3NO
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COMPUTED DESCRIPTORS
| Molecular Weight | 187.55 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 187.0011760 g/mol |
| Monoisotopic Mass | 187.0011760 g/mol |
| Topological Polar Surface Area | 21.6 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 179 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |