220652-98-2
Product Name:
3-METHYL-5-[4-(TRIFLUOROMETHYL)PHENYL]ISOXAZOLE-4-CARBOXYLIC ACID
Formula:
C12H8F3NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 271.19 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 271.04562760 g/mol |
| Monoisotopic Mass | 271.04562760 g/mol |
| Topological Polar Surface Area | 63.3 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 340 |
| 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 |