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871110-06-4

871110-06-4 structural image
Product Name: 3-METHYLTHIO-2-PHENYL-2,4-DIHYDRO-INDENO[1,2-C]PYRAZOLE
Formula: C17H14N2S
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COMPUTED DESCRIPTORS

Molecular Weight 278.4 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 278.08776963 g/mol
Monoisotopic Mass 278.08776963 g/mol
Topological Polar Surface Area 43.1 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 342
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