956201-93-7
Product Name:
1H-Pyrazole-4-carboxaldehyde, 5-chloro-1-(2,4-dimethylphenyl)-3-methyl-
Formula:
C13H13ClN2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 248.71 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 248.0716407 g/mol |
| Monoisotopic Mass | 248.0716407 g/mol |
| Topological Polar Surface Area | 34.9 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 287 |
| 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 |