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37040-48-5

37040-48-5 structural image
Product Name: 8-TRIFLUOROMETHYL-1,3,4,5-TETRAHYDRO-BENZOB1,4DIAZEPIN-2-ONE
Formula: C10H9F3N2O
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COMPUTED DESCRIPTORS

Molecular Weight 230.19 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 0
Exact Mass 230.06669740 g/mol
Monoisotopic Mass 230.06669740 g/mol
Topological Polar Surface Area 41.1 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 280
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes