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125127-62-0

125127-62-0 structural image
Product Name: 1-ETHYL-2-[(E)-2-(3-((E)-2-[1-ETHYLBENZO[CD]INDOL-2(1H)-YLIDENE]ETHYLIDENE)-2-PHENYL-1-CYCLOPENTEN-1-YL)ETHENYL]BENZO[CD]INDOLIUM TETRAFLUOROBORATE
Formula: C41H35BF4N2
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COMPUTED DESCRIPTORS

Molecular Weight 642.5 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 642.2829419 g/mol
Monoisotopic Mass 642.2829419 g/mol
Topological Polar Surface Area 6.2 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 1150
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 3
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes