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87261-28-7

87261-28-7 structural image
Product Name: 7-NITROBENZ(A)ANTHRACENE-TRANS-3,4-DIHYDRODIOL
Formula: C18H13NO4
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COMPUTED DESCRIPTORS

Molecular Weight 307.3 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 307.08445790 g/mol
Monoisotopic Mass 307.08445790 g/mol
Topological Polar Surface Area 86.3 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 502
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