165963-72-4
Product Name:
2-HYDROXY-4-[3-(TRIFLUOROMETHYL)-3H-DIAZIRIN-3-YL]BENZOIC ACID, METHYL ESTER
Formula:
C10H7F3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 260.17 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 260.04087658 g/mol |
| Monoisotopic Mass | 260.04087658 g/mol |
| Topological Polar Surface Area | 71.2 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 377 |
| 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 |