163213-29-4
Product Name:
DIMETHYL 1-(2-BROMOETHYL)-1H-PYRAZOLE-3,5-DICARBOXYLATE
Formula:
C9H11BrN2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 291.10 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 289.99022 g/mol |
| Monoisotopic Mass | 289.99022 g/mol |
| Topological Polar Surface Area | 70.4 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 274 |
| 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 |