294874-70-7
Product Name:
3-METHYL-5-(2-OXO-PROPYL)-1-PHENYL-1 H-PYRAZOLE-4-CARBOXYLIC ACID
Formula:
C14H14N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 258.27 g/mol |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 258.10044231 g/mol |
| Monoisotopic Mass | 258.10044231 g/mol |
| Topological Polar Surface Area | 72.2 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 353 |
| 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 |