251310-68-6
Product Name:
1,1,1-TRIFLUORO-3-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-2,4-PENTANEDIONE
Formula:
C14H14F3NO2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 285.26 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 3 |
Exact Mass | 285.09766318 g/mol |
Monoisotopic Mass | 285.09766318 g/mol |
Topological Polar Surface Area | 46.2 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 394 |
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 |