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86979-77-3

86979-77-3 structural image
Product Name: N,N-diethyl-2-(7-oxa-2,10-diazabicyclo[4.4.0]deca-2,4,11-trien-10-yl)e thanamine trihydrochloride
Formula: C13H24Cl3N3O
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COMPUTED DESCRIPTORS

Molecular Weight 344.7 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 343.098495 g/mol
Monoisotopic Mass 343.098495 g/mol
Topological Polar Surface Area 28.6 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 221
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 4
Compound Is Canonicalized Yes