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879635-12-8

879635-12-8 structural image
Product Name: 5-(1-aminoethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one hydrochloride
Formula: C4H9ClN4O
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COMPUTED DESCRIPTORS

Molecular Weight 164.59 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 164.0464886 g/mol
Monoisotopic Mass 164.0464886 g/mol
Topological Polar Surface Area 79.5 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 164
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 2
Compound Is Canonicalized Yes