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338966-70-4

338966-70-4 structural image
Product Name: 3-(3-BROMOPHENYL)-2-[5-(4-METHOXYBENZOYL)-2-THIENYL]ACRYLONITRILE
Formula: C21H14BrNO2S
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COMPUTED DESCRIPTORS

Molecular Weight 424.3 g/mol
XLogP3 5.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 422.99286 g/mol
Monoisotopic Mass 422.99286 g/mol
Topological Polar Surface Area 78.3 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 576
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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