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618101-74-9

618101-74-9 structural image
Product Name: 1-(3-CHLOROPHENYL)-3-(2,3-DIHYDROBENZO[B][1,4]DIOXIN-6-YL)-1H-PYRAZOLE-4-CARBALDEHYDE
Formula: C18H13ClN2O3
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COMPUTED DESCRIPTORS

Molecular Weight 340.8 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 340.0614700 g/mol
Monoisotopic Mass 340.0614700 g/mol
Topological Polar Surface Area 53.4 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 452
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