439121-24-1
Product Name:
5-(2-CHLORO-6-FLUOROPHENYL)-4-(1H-1,2,4-TRIAZOL-1-YL)-1,3-CYCLOHEXANEDIONE
Formula:
C14H11ClFN3O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 307.71 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 307.0523825 g/mol |
Monoisotopic Mass | 307.0523825 g/mol |
Topological Polar Surface Area | 64.8 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 436 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |