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618383-05-4

618383-05-4 structural image
Product Name: 3-(2,3-DIHYDROBENZO[B][1,4]DIOXIN-7-YL)-1-M-TOLYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
Formula: C19H16N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 336.3 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 336.11100700 g/mol
Monoisotopic Mass 336.11100700 g/mol
Topological Polar Surface Area 73.6 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 488
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 1
Compound Is Canonicalized Yes