1005584-44-0
Product Name:
2-(4-BROMO-5-METHYL-3-TRIFLUOROMETHYL-PYRAZOL-1-YL)-PROPIONIC ACID
Formula:
C8H8BrF3N2O2
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COMPUTED DESCRIPTORS
Molecular Weight | 301.06 g/mol |
---|---|
XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 2 |
Exact Mass | 299.97212 g/mol |
Monoisotopic Mass | 299.97212 g/mol |
Topological Polar Surface Area | 55.1 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 287 |
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 |