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331461-60-0

331461-60-0 structural image
Product Name: S-(4-CHLOROPHENYL) 3-(4-CYANOPHENYL)-2-PROPENETHIOATE
Formula: C16H10ClNOS
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COMPUTED DESCRIPTORS

Molecular Weight 299.8 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 299.0171628 g/mol
Monoisotopic Mass 299.0171628 g/mol
Topological Polar Surface Area 66.2 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 398
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