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230615-51-7

230615-51-7 structural image
Product Name: 2,3,4,5-Tetrahydro-3-(trifluoroacetyl)-1,5-methano-1H-3-benzazepine
Formula: C13H12F3NO
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COMPUTED DESCRIPTORS

Molecular Weight 255.23 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 255.08709849 g/mol
Monoisotopic Mass 255.08709849 g/mol
Topological Polar Surface Area 20.3 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 335
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

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