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905797-71-9

905797-71-9 structural image
Product Name: CHEMBRDG-BB 4024594
Formula: C9H9BrFNO
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1537

COMPUTED DESCRIPTORS

Molecular Weight 246.08 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 244.98515 g/mol
Monoisotopic Mass 244.98515 g/mol
Topological Polar Surface Area 29.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 181
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