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358629-39-7

358629-39-7 structural image
Product Name: 1-Pyrrolidineaceticacid,alpha-ethylidene-2-oxo-,(alphaZ)-(9CI)
Formula: C8H11NO3
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COMPUTED DESCRIPTORS

Molecular Weight 169.18 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 169.07389321 g/mol
Monoisotopic Mass 169.07389321 g/mol
Topological Polar Surface Area 57.6 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 245
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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