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828-04-6

828-04-6 structural image
Product Name: diethyl-(5-methyl-isoxazol-3-ylmethyl)-amine
Formula: C9H16N2O
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COMPUTED DESCRIPTORS

Molecular Weight 168.24 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 168.126263138 g/mol
Monoisotopic Mass 168.126263138 g/mol
Topological Polar Surface Area 29.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 126
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