845781-48-8
Product Name:
5-(3-CHLORO-4-FLUOROPHENYL)-3-METHYL-5-OXOVALERIC ACID
Formula:
C12H12ClFO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 258.67 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 258.0459001 g/mol |
| Monoisotopic Mass | 258.0459001 g/mol |
| Topological Polar Surface Area | 54.4 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 296 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |