84691-16-7
Product Name:
3-Isoxazolecarboxylicacid,4-hydroxy-,ethylester(9CI)
Formula:
C6H7NO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 157.12 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 157.03750770 g/mol |
| Monoisotopic Mass | 157.03750770 g/mol |
| Topological Polar Surface Area | 72.6 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 150 |
| 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 |