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881042-05-3

881042-05-3 structural image
Product Name: 2-[(2,6-DIMETHYL-4-PYRIDINYL)METHYL]HEXAHYDRO-1H-AZEPINE
Formula: C14H22N2
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COMPUTED DESCRIPTORS

Molecular Weight 218.34 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 218.178298710 g/mol
Monoisotopic Mass 218.178298710 g/mol
Topological Polar Surface Area 24.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 195
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