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726134-79-8

726134-79-8 structural image
Product Name: BENZENEPROPANOL, B,4-DIAMINO-, (S)-
Formula: C9H14N2O
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COMPUTED DESCRIPTORS

Molecular Weight 166.22 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 166.110613074 g/mol
Monoisotopic Mass 166.110613074 g/mol
Topological Polar Surface Area 72.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 122
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes