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141807-58-1

141807-58-1 structural image
Product Name: 3-DEOXY-3-(P-IODOPHENYL)BETA-ECGONINE
Formula: C15H18INO2
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COMPUTED DESCRIPTORS

Molecular Weight 371.21 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 371.03823 g/mol
Monoisotopic Mass 371.03823 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 354
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes