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81785-29-7

81785-29-7 structural image
Product Name: 5-(2-Hydroxy-3-(3-tolyloxy)-propylamino)-5-desoxy-1,4:3,6-dianhydro-L- idit-2-nitrat HCl
Formula: C16H22N2O7.ClH
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COMPUTED DESCRIPTORS

Molecular Weight 390.8 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 7
Exact Mass 390.1193788 g/mol
Monoisotopic Mass 390.1193788 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 447
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes