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Homecas94769-27-4

94769-27-4

94769-27-4 structural image
Product Name: 2,4-Piperidinedicarboxylic acid, 1-(3-(acetylthio)-1-oxopropyl)-, cis-
Formula: C12H17NO6S
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COMPUTED DESCRIPTORS

Molecular Weight 303.33 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 303.07765844 g/mol
Monoisotopic Mass 303.07765844 g/mol
Topological Polar Surface Area 137 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 424
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