1076197-28-8
Product Name:
5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylic acid
Formula:
C11H8N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 228.21 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 228.06472551 g/mol |
| Monoisotopic Mass | 228.06472551 g/mol |
| Topological Polar Surface Area | 105 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 345 |
| 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 |