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1437769-91-9

1437769-91-9 structural image
Product Name: 1-Isothiocyanato-4-(1,2,2-triphenylethenyl)benzene
Formula: C27H19NS
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COMPUTED DESCRIPTORS

Molecular Weight 389.5 g/mol
XLogP3 9.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 389.12382078 g/mol
Monoisotopic Mass 389.12382078 g/mol
Topological Polar Surface Area 44.4 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 556
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