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1135226-72-0

1135226-72-0 structural image
Product Name: METHYL (2S,4S)-4-(4-BROMO-2-FLUOROPHENOXY)-2-PYRROLIDINECARBOXYLATE
Formula: C12H13BrFNO3
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COMPUTED DESCRIPTORS

Molecular Weight 318.14 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 317.00628 g/mol
Monoisotopic Mass 317.00628 g/mol
Topological Polar Surface Area 47.6 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 305
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