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111900-31-3

111900-31-3 structural image
Product Name: (1S,3R)-ACPD
Formula: C7H11NO4
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COMPUTED DESCRIPTORS

Molecular Weight 173.17 g/mol
XLogP3 -3.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 173.06880783 g/mol
Monoisotopic Mass 173.06880783 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 227
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes