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77965-44-7

77965-44-7 structural image
Product Name: 1-(beta-Dimethylaminoaethyl)-2-methoxycarbonyl-3-benzyloxy-5-chlor-ind ol-toluol-4-sulfonat
Formula: C21H23ClN2O3.C7H8O3S
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COMPUTED DESCRIPTORS

Molecular Weight 559.1 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 558.1591356 g/mol
Monoisotopic Mass 558.1591356 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 38
Formal Charge 0
Complexity 690
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes