312601-70-0
Product Name:
4-(4-CHLORO-3-NITRO-PYRAZOL-1-YLMETHYL)-BENZOIC ACID
Formula:
C11H8ClN3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 281.65 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 281.0203334 g/mol |
| Monoisotopic Mass | 281.0203334 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 354 |
| 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 |